[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-[(4-chlorophenyl)sulfonylamino]propanoate

Systemtic Name: [2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-[(4-chlorophenyl)sulfonylamino]propanoate Openeye Name: [2-(2-bromo-4-methyl-anilino)-2-oxo-ethyl] 3-[(4-chlorophenyl)sulfonylamino]propanoate CAS Name: 3-[(4-chlorophenyl)sulfonylamino]propanoic acid [2-(2-bromo-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-bromo-4-methylanilino)-2-oxoethyl] 3-[(4-chlorophenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-chlorophenyl)sulfonylamino]propionic acid [2-(2-bromo-4-methyl-anilino)-2-keto-ethyl] ester Formula: C18H18BrClN2O5S MolecularWeight: 489.76792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)COC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Cl)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)COC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Cl)Br

InChI

InChI=1S/C18H18BrClN2O5S/c1-12-2-7-16(15(19)10-12)22-17(23)11-27-18(24)8-9-21-28(25,26)14-5-3-13(20)4-6-14/h2-7,10,21H,8-9,11H2,1H3,(H,22,23)