ethyl 4-[[(3S)-1-(3,5-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[(3S)-1-(3,5-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[(3S)-1-(3,5-dimethylphenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 4-[[[(3S)-1-(3,5-dimethylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(3S)-1-(3,5-dimethylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 4-[[(3S)-1-(3,5-dimethylphenyl)-5-keto-pyrrolidine-3-carbonyl]amino]benzoic acid ethyl ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=O)N(C2)C3=CC(=CC(=C3)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)[C@H]2CC(=O)N(C2)C3=CC(=CC(=C3)C)C

InChI

InChI=1S/C22H24N2O4/c1-4-28-22(27)16-5-7-18(8-6-16)23-21(26)17-12-20(25)24(13-17)19-10-14(2)9-15(3)11-19/h5-11,17H,4,12-13H2,1-3H3,(H,23,26)/t17-/m0/s1