propyl 4-[[(3S)-1-(2,6-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate

Systemtic Name: propyl 4-[[(3S)-1-(2,6-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: propyl 4-[[(3S)-1-(2,6-dimethylphenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 4-[[[(3S)-1-(2,6-dimethylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[(3S)-1-(2,6-dimethylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 4-[[(3S)-1-(2,6-dimethylphenyl)-5-keto-pyrrolidine-3-carbonyl]amino]benzoic acid propyl ester Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=O)N(C2)C3=C(C=CC=C3C)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)[C@H]2CC(=O)N(C2)C3=C(C=CC=C3C)C

InChI

InChI=1S/C23H26N2O4/c1-4-12-29-23(28)17-8-10-19(11-9-17)24-22(27)18-13-20(26)25(14-18)21-15(2)6-5-7-16(21)3/h5-11,18H,4,12-14H2,1-3H3,(H,24,27)/t18-/m0/s1