[2-[1-(4-bromophenyl)ethylamino]-2-oxidanylidene-ethyl] 4-(2-methoxy-5-methyl-phenyl)-4-oxidanylidene-butanoate

Systemtic Name: [2-[1-(4-bromophenyl)ethylamino]-2-oxidanylidene-ethyl] 4-(2-methoxy-5-methyl-phenyl)-4-oxidanylidene-butanoate Openeye Name: [2-[1-(4-bromophenyl)ethylamino]-2-oxo-ethyl] 4-(2-methoxy-5-methyl-phenyl)-4-oxo-butanoate CAS Name: 4-(2-methoxy-5-methylphenyl)-4-oxobutanoic acid [2-[1-(4-bromophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(4-bromophenyl)ethylamino]-2-oxoethyl] 4-(2-methoxy-5-methylphenyl)-4-oxobutanoate Traditional Name: 4-keto-4-(2-methoxy-5-methyl-phenyl)butyric acid [2-[1-(4-bromophenyl)ethylamino]-2-keto-ethyl] ester Formula: C22H24BrNO5 MolecularWeight: 462.33366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(=O)CCC(=O)OCC(=O)NC(C)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(=O)CCC(=O)OCC(=O)NC(C)C2=CC=C(C=C2)Br

InChI

InChI=1S/C22H24BrNO5/c1-14-4-10-20(28-3)18(12-14)19(25)9-11-22(27)29-13-21(26)24-15(2)16-5-7-17(23)8-6-16/h4-8,10,12,15H,9,11,13H2,1-3H3,(H,24,26)