[2-[2-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl] pyridine-4-carboxylate

Systemtic Name: [2-[2-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl] pyridine-4-carboxylate Openeye Name: [2-[2-(3-chlorophenyl)ethylamino]-2-oxo-ethyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [2-[2-(3-chlorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(3-chlorophenyl)ethylamino]-2-oxoethyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [2-[2-(3-chlorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C16H15ClN2O3 MolecularWeight: 318.7549

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CCNC(=O)COC(=O)C2=CC=NC=C2

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CCNC(=O)COC(=O)C2=CC=NC=C2

InChI

InChI=1S/C16H15ClN2O3/c17-14-3-1-2-12(10-14)4-9-19-15(20)11-22-16(21)13-5-7-18-8-6-13/h1-3,5-8,10H,4,9,11H2,(H,19,20)