[2-[(4-bromanyl-3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-(4-butoxycarbonylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(4-bromanyl-3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-(4-butoxycarbonylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromo-3-chloro-2-methyl-anilino)-2-oxo-ethyl] 1-(4-butoxycarbonylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-[4-[butoxy(oxo)methyl]phenyl]-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-bromo-3-chloro-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-3-chloro-2-methylanilino)-2-oxoethyl] 1-(4-butoxycarbonylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-(4-butoxycarbonylphenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-(4-bromo-3-chloro-2-methyl-anilino)-2-keto-ethyl] ester Formula: C25H26BrClN2O6 MolecularWeight: 565.84074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)NC3=C(C(=C(C=C3)Br)Cl)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)NC3=C(C(=C(C=C3)Br)Cl)C

InChI

InChI=1S/C25H26BrClN2O6/c1-3-4-11-34-24(32)16-5-7-18(8-6-16)29-13-17(12-22(29)31)25(33)35-14-21(30)28-20-10-9-19(26)23(27)15(20)2/h5-10,17H,3-4,11-14H2,1-2H3,(H,28,30)