1-[5-[[2-chloranyl-5-[(phenylmethyl)amino]phenoxy]methyl]pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile

Systemtic Name: 1-[5-[[2-chloranyl-5-[(phenylmethyl)amino]phenoxy]methyl]pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile Openeye Name: 1-[5-[[5-(benzylamino)-2-chloro-phenoxy]methyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile CAS Name: 1-[[5-[[2-chloro-5-[(phenylmethyl)amino]phenoxy]methyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarbonitrile IUPAC Name: 1-[5-[[5-(benzylamino)-2-chlorophenoxy]methyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile Traditional Name: 1-[5-[[5-(benzylamino)-2-chloro-phenoxy]methyl]prolyl]pyrrolidine-2-carbonitrile Formula: C24H27ClN4O2 MolecularWeight: 438.94978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CCC(N2)COC3=C(C=CC(=C3)NCC4=CC=CC=C4)Cl)C#N

Isomeric SMILES

C1CC(N(C1)C(=O)C2CCC(N2)COC3=C(C=CC(=C3)NCC4=CC=CC=C4)Cl)C#N

InChI

InChI=1S/C24H27ClN4O2/c25-21-10-8-18(27-15-17-5-2-1-3-6-17)13-23(21)31-16-19-9-11-22(28-19)24(30)29-12-4-7-20(29)14-26/h1-3,5-6,8,10,13,19-20,22,27-28H,4,7,9,11-12,15-16H2