2-[(4-butoxyphenyl)amino]pyridine-3-carboxylate

Systemtic Name: 2-[(4-butoxyphenyl)amino]pyridine-3-carboxylate Openeye Name: 2-(4-butoxyanilino)pyridine-3-carboxylate CAS Name: 2-(4-butoxyanilino)-3-pyridinecarboxylate IUPAC Name: 2-(4-butoxyanilino)pyridine-3-carboxylate Traditional Name: 2-(4-butoxyanilino)nicotinate Formula: C16H17N2O3- MolecularWeight: 285.31778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)[O-]

InChI

InChI=1S/C16H18N2O3/c1-2-3-11-21-13-8-6-12(7-9-13)18-15-14(16(19)20)5-4-10-17-15/h4-10H,2-3,11H2,1H3,(H,17,18)(H,19,20)/p-1