[2-[(4-chloranyl-3-propoxycarbonyl-phenyl)amino]-2-oxidanylidene-ethyl] pyridine-3-carboxylate

Systemtic Name: [2-[(4-chloranyl-3-propoxycarbonyl-phenyl)amino]-2-oxidanylidene-ethyl] pyridine-3-carboxylate Openeye Name: [2-(4-chloro-3-propoxycarbonyl-anilino)-2-oxo-ethyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-[4-chloro-3-[oxo(propoxy)methyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-3-propoxycarbonylanilino)-2-oxoethyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-(4-chloro-3-propoxycarbonyl-anilino)-2-keto-ethyl] ester Formula: C18H17ClN2O5 MolecularWeight: 376.79098

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(C=CC(=C1)NC(=O)COC(=O)C2=CN=CC=C2)Cl

Isomeric SMILES

CCCOC(=O)C1=C(C=CC(=C1)NC(=O)COC(=O)C2=CN=CC=C2)Cl

InChI

InChI=1S/C18H17ClN2O5/c1-2-8-25-18(24)14-9-13(5-6-15(14)19)21-16(22)11-26-17(23)12-4-3-7-20-10-12/h3-7,9-10H,2,8,11H2,1H3,(H,21,22)