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

Systemtic Name: methyl 4-[[(3S)-1-(2-ethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[(3S)-1-(2-ethoxyphenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 4-[[[(3S)-1-(2-ethoxyphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(3S)-1-(2-ethoxyphenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 4-[[(3S)-5-keto-1-o-phenetyl-pyrrolidine-3-carbonyl]amino]benzoic acid methyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC(CC2=O)C(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCOC1=CC=CC=C1N2C[C@H](CC2=O)C(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

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