ethyl 3-[[(3S)-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[(3S)-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[[(3S)-1-(3-methoxyphenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 3-[[[(3S)-1-(3-methoxyphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[(3S)-1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 3-[[(3S)-5-keto-1-(3-methoxyphenyl)pyrrolidine-3-carbonyl]amino]benzoic acid ethyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O5/c1-3-28-21(26)14-6-4-7-16(10-14)22-20(25)15-11-19(24)23(13-15)17-8-5-9-18(12-17)27-2/h4-10,12,15H,3,11,13H2,1-2H3,(H,22,25)/t15-/m0/s1