[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] (3S)-1-(2-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] (3S)-1-(2-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(2,5-dimethylanilino)-2-oxo-ethyl] (3S)-1-(2-methoxyphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(2,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylanilino)-2-oxoethyl] (3S)-1-(2-methoxyphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-(2-methoxyphenyl)pyrrolidine-3-carboxylic acid [2-(2,5-dimethylanilino)-2-keto-ethyl] ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)COC(=O)C2CC(=O)N(C2)C3=CC=CC=C3OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)COC(=O)[C@H]2CC(=O)N(C2)C3=CC=CC=C3OC

InChI

InChI=1S/C22H24N2O5/c1-14-8-9-15(2)17(10-14)23-20(25)13-29-22(27)16-11-21(26)24(12-16)18-6-4-5-7-19(18)28-3/h4-10,16H,11-13H2,1-3H3,(H,23,25)/t16-/m0/s1