ethyl 4-[[(3S)-1-(2-methoxy-5-methyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[(3S)-1-(2-methoxy-5-methyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[(3S)-1-(2-methoxy-5-methyl-phenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 4-[[[(3S)-1-(2-methoxy-5-methylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(3S)-1-(2-methoxy-5-methylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 4-[[(3S)-5-keto-1-(2-methoxy-5-methyl-phenyl)pyrrolidine-3-carbonyl]amino]benzoic acid ethyl ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O5/c1-4-29-22(27)15-6-8-17(9-7-15)23-21(26)16-12-20(25)24(13-16)18-11-14(2)5-10-19(18)28-3/h5-11,16H,4,12-13H2,1-3H3,(H,23,26)/t16-/m0/s1