4-[[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]-2-methyl-4-oxidanylidene-2-phenyl-butanoic acid

Systemtic Name: 4-[[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]-2-methyl-4-oxidanylidene-2-phenyl-butanoic acid Openeye Name: 4-[3-chloro-4-(2-oxopyrrolidin-1-yl)anilino]-2-methyl-4-oxo-2-phenyl-butanoic acid CAS Name: 4-[3-chloro-4-(2-oxo-1-pyrrolidinyl)anilino]-2-methyl-4-oxo-2-phenylbutanoic acid IUPAC Name: 4-[3-chloro-4-(2-oxopyrrolidin-1-yl)anilino]-2-methyl-4-oxo-2-phenylbutanoic acid Traditional Name: 4-[3-chloro-4-(2-ketopyrrolidino)anilino]-4-keto-2-methyl-2-phenyl-butyric acid Formula: C21H21ClN2O4 MolecularWeight: 400.85544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC(=C(C=C1)N2CCCC2=O)Cl)(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(CC(=O)NC1=CC(=C(C=C1)N2CCCC2=O)Cl)(C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H21ClN2O4/c1-21(20(27)28,14-6-3-2-4-7-14)13-18(25)23-15-9-10-17(16(22)12-15)24-11-5-8-19(24)26/h2-4,6-7,9-10,12H,5,8,11,13H2,1H3,(H,23,25)(H,27,28)