[1-[methyl(phenyl)amino]-1-oxidanylidene-propan-2-yl] 4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]benzoate

Systemtic Name: [1-[methyl(phenyl)amino]-1-oxidanylidene-propan-2-yl] 4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]benzoate Openeye Name: [1-methyl-2-(N-methylanilino)-2-oxo-ethyl] 4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]benzoate CAS Name: 4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]benzoic acid [1-(N-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(N-methylanilino)-1-oxopropan-2-yl] 4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]benzoate Traditional Name: 4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]benzoic acid [2-keto-1-methyl-2-(N-methylanilino)ethyl] ester Formula: C25H25BrN2O6S MolecularWeight: 561.4448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OC(C)C(=O)N(C)C3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OC(C)C(=O)N(C)C3=CC=CC=C3

InChI

InChI=1S/C25H25BrN2O6S/c1-4-33-22-15-12-19(26)16-23(22)35(31,32)27-20-13-10-18(11-14-20)25(30)34-17(2)24(29)28(3)21-8-6-5-7-9-21/h5-17,27H,4H2,1-3H3