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

Systemtic Name: [2-oxidanylidene-2-(3-phenylpropylamino)ethyl] pyridine-3-carboxylate Openeye Name: [2-oxo-2-(3-phenylpropylamino)ethyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-oxo-2-(3-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylpropylamino)ethyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-keto-2-(3-phenylpropylamino)ethyl] ester Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O3/c20-16(13-22-17(21)15-9-5-10-18-12-15)19-11-4-8-14-6-2-1-3-7-14/h1-3,5-7,9-10,12H,4,8,11,13H2,(H,19,20)