[2-[[(1S)-1,2-diphenylethyl]amino]-2-oxidanylidene-ethyl] 4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-[[(1S)-1,2-diphenylethyl]amino]-2-oxidanylidene-ethyl] 4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: [2-[[(1S)-1,2-diphenylethyl]amino]-2-oxo-ethyl] 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid [2-[[(1S)-1,2-diphenylethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1S)-1,2-diphenylethyl]amino]-2-oxoethyl] 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid [2-[[(1S)-1,2-diphenylethyl]amino]-2-keto-ethyl] ester Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)OCC(=O)NC(CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)OCC(=O)N[C@@H](CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H26N2O4/c1-16-23(18(3)28)17(2)26-24(16)25(30)31-15-22(29)27-21(20-12-8-5-9-13-20)14-19-10-6-4-7-11-19/h4-13,21,26H,14-15H2,1-3H3,(H,27,29)/t21-/m0/s1