3-cyanopropyl 1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: 3-cyanopropyl 1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: 3-cyanopropyl 5-oxo-1-(p-tolyl)pyrrolidine-3-carboxylate CAS Name: 1-(4-methylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 5-keto-1-(p-tolyl)pyrrolidine-3-carboxylic acid 3-cyanopropyl ester Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCCCC#N

Isomeric SMILES

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCCCC#N

InChI

InChI=1S/C16H18N2O3/c1-12-4-6-14(7-5-12)18-11-13(10-15(18)19)16(20)21-9-3-2-8-17/h4-7,13H,2-3,9-11H2,1H3