methyl 6-oxidanylidene-1-[2-oxidanylidene-2-(3-phenylpropylamino)ethyl]pyridine-3-carboxylate

Systemtic Name: methyl 6-oxidanylidene-1-[2-oxidanylidene-2-(3-phenylpropylamino)ethyl]pyridine-3-carboxylate Openeye Name: methyl 6-oxo-1-[2-oxo-2-(3-phenylpropylamino)ethyl]pyridine-3-carboxylate CAS Name: 6-oxo-1-[2-oxo-2-(3-phenylpropylamino)ethyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-oxo-1-[2-oxo-2-(3-phenylpropylamino)ethyl]pyridine-3-carboxylate Traditional Name: 6-keto-1-[2-keto-2-(3-phenylpropylamino)ethyl]nicotinic acid methyl ester Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C=C1)CC(=O)NCCCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CN(C(=O)C=C1)CC(=O)NCCCC2=CC=CC=C2

InChI

InChI=1S/C18H20N2O4/c1-24-18(23)15-9-10-17(22)20(12-15)13-16(21)19-11-5-8-14-6-3-2-4-7-14/h2-4,6-7,9-10,12H,5,8,11,13H2,1H3,(H,19,21)