2-[(4-butoxyphenyl)carbamoyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[(4-butoxyphenyl)carbamoyl]pyridine-3-carboxylic acid Openeye Name: 2-[(4-butoxyphenyl)carbamoyl]pyridine-3-carboxylic acid CAS Name: 2-[(4-butoxyanilino)-oxomethyl]-3-pyridinecarboxylic acid IUPAC Name: 2-[(4-butoxyphenyl)carbamoyl]pyridine-3-carboxylic acid Traditional Name: 2-[(4-butoxyphenyl)carbamoyl]nicotinic acid Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)C2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)C2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C17H18N2O4/c1-2-3-11-23-13-8-6-12(7-9-13)19-16(20)15-14(17(21)22)5-4-10-18-15/h4-10H,2-3,11H2,1H3,(H,19,20)(H,21,22)