propan-2-yl 4-[[1-(3-chloranyl-4-methyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate

Systemtic Name: propan-2-yl 4-[[1-(3-chloranyl-4-methyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: isopropyl 4-[[1-(3-chloro-4-methyl-phenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 4-[[[1-(3-chloro-4-methylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[1-(3-chloro-4-methylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 4-[[1-(3-chloro-4-methyl-phenyl)-5-keto-pyrrolidine-3-carbonyl]amino]benzoic acid isopropyl ester Formula: C22H23ClN2O4 MolecularWeight: 414.88202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC=C(C=C3)C(=O)OC(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC=C(C=C3)C(=O)OC(C)C)Cl

InChI

InChI=1S/C22H23ClN2O4/c1-13(2)29-22(28)15-5-7-17(8-6-15)24-21(27)16-10-20(26)25(12-16)18-9-4-14(3)19(23)11-18/h4-9,11,13,16H,10,12H2,1-3H3,(H,24,27)