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

Systemtic Name: ethyl 4-[[(3S)-1-(4-ethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[(3S)-1-(4-ethylphenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 4-[[[(3S)-1-(4-ethylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(3S)-1-(4-ethylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 4-[[(3S)-1-(4-ethylphenyl)-5-keto-pyrrolidine-3-carbonyl]amino]benzoic acid ethyl ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)NC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C22H24N2O4/c1-3-15-5-11-19(12-6-15)24-14-17(13-20(24)25)21(26)23-18-9-7-16(8-10-18)22(27)28-4-2/h5-12,17H,3-4,13-14H2,1-2H3,(H,23,26)/t17-/m0/s1