VCZ
3-acetamido-4-methoxy-benzoic acid
Created: | 2023-03-01 |
Last modified: | 2024-01-10 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 26 |
Chiral Atom Count | 0 |
Bond Count | 26 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | 3-acetamido-4-methoxy-benzoic acid |
Systematic Name (OpenEye OEToolkits) | 3-acetamido-4-methoxy-benzoic acid |
Formula | C10 H11 N O4 |
Molecular Weight | 209.199 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | COc1ccc(cc1NC(C)=O)C(O)=O |
SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)Nc1cc(ccc1OC)C(=O)O |
Canonical SMILES | CACTVS | 3.385 | COc1ccc(cc1NC(C)=O)C(O)=O |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)Nc1cc(ccc1OC)C(=O)O |
InChI | InChI | 1.06 | InChI=1S/C10H11NO4/c1-6(12)11-8-5-7(10(13)14)3-4-9(8)15-2/h3-5H,1-2H3,(H,11,12)(H,13,14) |
InChIKey | InChI | 1.06 | AATMJTHPDWWQRU-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 3611306 |