7VF
4-(3-methyl-4-oxidanyl-phenyl)quinolin-7-ol
Created: | 2017-01-19 |
Last modified: | 2017-12-13 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 32 |
Chiral Atom Count | 0 |
Bond Count | 34 |
Aromatic Bond Count | 17 |
Chemical Component Summary | |
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Name | 4-(3-methyl-4-oxidanyl-phenyl)quinolin-7-ol |
Systematic Name (OpenEye OEToolkits) | 4-(3-methyl-4-oxidanyl-phenyl)quinolin-7-ol |
Formula | C16 H13 N O2 |
Molecular Weight | 251.28 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | Cc1cc(ccc1O)c2ccnc3cc(O)ccc23 |
SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cc(ccc1O)c2ccnc3c2ccc(c3)O |
Canonical SMILES | CACTVS | 3.385 | Cc1cc(ccc1O)c2ccnc3cc(O)ccc23 |
Canonical SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cc(ccc1O)c2ccnc3c2ccc(c3)O |
InChI | InChI | 1.03 | InChI=1S/C16H13NO2/c1-10-8-11(2-5-16(10)19)13-6-7-17-15-9-12(18)3-4-14(13)15/h2-9,18-19H,1H3 |
InChIKey | InChI | 1.03 | QXFYDRYRLOHSBD-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 135567366 |