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

Systemtic Name: 2-[(4-butylphenyl)amino]pyridine-3-carboxylate Openeye Name: 2-(4-butylanilino)pyridine-3-carboxylate CAS Name: 2-(4-butylanilino)-3-pyridinecarboxylate IUPAC Name: 2-(4-butylanilino)pyridine-3-carboxylate Traditional Name: 2-(4-butylanilino)nicotinate Formula: C16H17N2O2- MolecularWeight: 269.31838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)[O-]

InChI

InChI=1S/C16H18N2O2/c1-2-3-5-12-7-9-13(10-8-12)18-15-14(16(19)20)6-4-11-17-15/h4,6-11H,2-3,5H2,1H3,(H,17,18)(H,19,20)/p-1