[1-[(4-dimethylaminophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-[(4-bromophenyl)sulfonylamino]benzoate

Systemtic Name: [1-[(4-dimethylaminophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-[(4-bromophenyl)sulfonylamino]benzoate Openeye Name: [2-[4-(dimethylamino)anilino]-1-methyl-2-oxo-ethyl] 4-[(4-bromophenyl)sulfonylamino]benzoate CAS Name: 4-[(4-bromophenyl)sulfonylamino]benzoic acid [1-[4-(dimethylamino)anilino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[4-(dimethylamino)anilino]-1-oxopropan-2-yl] 4-[(4-bromophenyl)sulfonylamino]benzoate Traditional Name: 4-(brosylamino)benzoic acid [2-[4-(dimethylamino)anilino]-2-keto-1-methyl-ethyl] ester Formula: C24H24BrN3O5S MolecularWeight: 546.43346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N(C)C)OC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N(C)C)OC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C24H24BrN3O5S/c1-16(23(29)26-19-10-12-21(13-11-19)28(2)3)33-24(30)17-4-8-20(9-5-17)27-34(31,32)22-14-6-18(25)7-15-22/h4-16,27H,1-3H3,(H,26,29)