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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC=CC=C3C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)NC3=CC=CC=C3C(=O)OCC

InChI

InChI=1S/C22H24N2O5/c1-3-28-17-11-9-16(10-12-17)24-14-15(13-20(24)25)21(26)23-19-8-6-5-7-18(19)22(27)29-4-2/h5-12,15H,3-4,13-14H2,1-2H3,(H,23,26)/t15-/m0/s1