2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]pyridine-3-carboxylic acid Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]pyridine-3-carboxylic acid CAS Name: 2-[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]pyridine-3-carboxylic acid Traditional Name: 2-(homoveratrylcarbamoyl)nicotinic acid Formula: C17H18N2O5 MolecularWeight: 330.33522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=C(C=CC=N2)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=C(C=CC=N2)C(=O)O)OC

InChI

InChI=1S/C17H18N2O5/c1-23-13-6-5-11(10-14(13)24-2)7-9-19-16(20)15-12(17(21)22)4-3-8-18-15/h3-6,8,10H,7,9H2,1-2H3,(H,19,20)(H,21,22)