AMM
(2S)-2-{[(AMINOMETHYL)(DIHYDROXY)SILYL]METHYL}-4-METHYLPENTANAL
Created: | 2005-01-14 |
Last modified: | 2011-06-04 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 32 |
Chiral Atom Count | 1 |
Bond Count | 31 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | (2S)-2-{[(AMINOMETHYL)(DIHYDROXY)SILYL]METHYL}-4-METHYLPENTANAL |
Systematic Name (OpenEye OEToolkits) | (2S)-2-[(aminomethyl-dihydroxy-silyl)methyl]-4-methyl-pentanal |
Formula | C8 H19 N O3 Si |
Molecular Weight | 205.327 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=CC(CC(C)C)C[Si](O)(O)CN |
SMILES | CACTVS | 3.341 | CC(C)C[CH](C[Si](O)(O)CN)C=O |
SMILES | OpenEye OEToolkits | 1.5.0 | CC(C)CC(C[Si](CN)(O)O)C=O |
Canonical SMILES | CACTVS | 3.341 | CC(C)C[C@H](C[Si](O)(O)CN)C=O |
Canonical SMILES | OpenEye OEToolkits | 1.5.0 | CC(C)C[C@H](C[Si](CN)(O)O)C=O |
InChI | InChI | 1.03 | InChI=1S/C8H19NO3Si/c1-7(2)3-8(4-10)5-13(11,12)6-9/h4,7-8,11-12H,3,5-6,9H2,1-2H3/t8-/m0/s1 |
InChIKey | InChI | 1.03 | ZZKRIEGAOOCWBS-QMMMGPOBSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 5494407 |