tert-butyl 2-(4-cyanophenyl)-3-oxidanylidene-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-(4-cyanophenyl)-3-oxidanylidene-pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-(4-cyanophenyl)-3-oxo-pyrrolidine-1-carboxylate CAS Name: 2-(4-cyanophenyl)-3-oxo-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-cyanophenyl)-3-oxopyrrolidine-1-carboxylate Traditional Name: 2-(4-cyanophenyl)-3-keto-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(=O)C1C2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(=O)C1C2=CC=C(C=C2)C#N

InChI

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