2-chloranyl-4-[[(3S)-1-methyl-5-oxidanylidene-pyrrolidin-3-yl]-(phenylmethyl)amino]benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-[[(3S)-1-methyl-5-oxidanylidene-pyrrolidin-3-yl]-(phenylmethyl)amino]benzenecarbonitrile Openeye Name: 4-[benzyl-[(3S)-1-methyl-5-oxo-pyrrolidin-3-yl]amino]-2-chloro-benzonitrile CAS Name: 2-chloro-4-[[(3S)-1-methyl-5-oxo-3-pyrrolidinyl]-(phenylmethyl)amino]benzonitrile IUPAC Name: 4-[benzyl-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]amino]-2-chlorobenzonitrile Traditional Name: 4-[benzyl-[(3S)-5-keto-1-methyl-pyrrolidin-3-yl]amino]-2-chloro-benzonitrile Formula: C19H18ClN3O MolecularWeight: 339.81872

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(CC1=O)N(CC2=CC=CC=C2)C3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

CN1C[C@H](CC1=O)N(CC2=CC=CC=C2)C3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C19H18ClN3O/c1-22-13-17(10-19(22)24)23(12-14-5-3-2-4-6-14)16-8-7-15(11-21)18(20)9-16/h2-9,17H,10,12-13H2,1H3/t17-/m0/s1