[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] (3S)-1-(2,6-diethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] (3S)-1-(2,6-diethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(2-methylanilino)-2-oxo-ethyl] (3S)-1-(2,6-diethylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2,6-diethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylanilino)-2-oxoethyl] (3S)-1-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(2,6-diethylphenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-keto-2-(o-toluidino)ethyl] ester Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)N2CC(CC2=O)C(=O)OCC(=O)NC3=CC=CC=C3C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)N2C[C@H](CC2=O)C(=O)OCC(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C24H28N2O4/c1-4-17-10-8-11-18(5-2)23(17)26-14-19(13-22(26)28)24(29)30-15-21(27)25-20-12-7-6-9-16(20)3/h6-12,19H,4-5,13-15H2,1-3H3,(H,25,27)/t19-/m0/s1