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

Systemtic Name: ethyl 4-[[(3S)-1-[(4-methylphenyl)methyl]-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[(3S)-5-oxo-1-(p-tolylmethyl)pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 4-[[[(3S)-1-[(4-methylphenyl)methyl]-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(3S)-1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 4-[[(3S)-5-keto-1-(4-methylbenzyl)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)CC3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)[C@H]2CC(=O)N(C2)CC3=CC=C(C=C3)C

InChI

InChI=1S/C22H24N2O4/c1-3-28-22(27)17-8-10-19(11-9-17)23-21(26)18-12-20(25)24(14-18)13-16-6-4-15(2)5-7-16/h4-11,18H,3,12-14H2,1-2H3,(H,23,26)/t18-/m0/s1