4-[2-[2-(2-chlorophenyl)pyrrolidin-1-yl]-2-oxidanylidene-1-phenylazanyl-ethyl]benzenecarbonitrile

Systemtic Name: 4-[2-[2-(2-chlorophenyl)pyrrolidin-1-yl]-2-oxidanylidene-1-phenylazanyl-ethyl]benzenecarbonitrile Openeye Name: 4-[1-anilino-2-[2-(2-chlorophenyl)pyrrolidin-1-yl]-2-oxo-ethyl]benzonitrile CAS Name: 4-[1-anilino-2-[2-(2-chlorophenyl)-1-pyrrolidinyl]-2-oxoethyl]benzonitrile IUPAC Name: 4-[1-anilino-2-[2-(2-chlorophenyl)pyrrolidin-1-yl]-2-oxoethyl]benzonitrile Traditional Name: 4-[1-anilino-2-[2-(2-chlorophenyl)pyrrolidino]-2-keto-ethyl]benzonitrile Formula: C25H22ClN3O MolecularWeight: 415.91468

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(C2=CC=C(C=C2)C#N)NC3=CC=CC=C3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CC(N(C1)C(=O)C(C2=CC=C(C=C2)C#N)NC3=CC=CC=C3)C4=CC=CC=C4Cl

InChI

InChI=1S/C25H22ClN3O/c26-22-10-5-4-9-21(22)23-11-6-16-29(23)25(30)24(28-20-7-2-1-3-8-20)19-14-12-18(17-27)13-15-19/h1-5,7-10,12-15,23-24,28H,6,11,16H2