[2-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-[(4-methylphenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-[(4-methylphenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromo-2,6-dimethyl-anilino)-2-oxo-ethyl] 5-oxo-1-(p-tolylmethyl)pyrrolidine-3-carboxylate CAS Name: 1-[(4-methylphenyl)methyl]-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-bromo-2,6-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2,6-dimethylanilino)-2-oxoethyl] 1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: 5-keto-1-(4-methylbenzyl)pyrrolidine-3-carboxylic acid [2-(4-bromo-2,6-dimethyl-anilino)-2-keto-ethyl] ester Formula: C23H25BrN2O4 MolecularWeight: 473.3596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CC(CC2=O)C(=O)OCC(=O)NC3=C(C=C(C=C3C)Br)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CC(CC2=O)C(=O)OCC(=O)NC3=C(C=C(C=C3C)Br)C

InChI

InChI=1S/C23H25BrN2O4/c1-14-4-6-17(7-5-14)11-26-12-18(10-21(26)28)23(29)30-13-20(27)25-22-15(2)8-19(24)9-16(22)3/h4-9,18H,10-13H2,1-3H3,(H,25,27)