[2-bromanyl-4-[(4-methylphenyl)sulfonylamino]phenyl] benzoate

Systemtic Name: [2-bromanyl-4-[(4-methylphenyl)sulfonylamino]phenyl] benzoate Openeye Name: [2-bromo-4-(p-tolylsulfonylamino)phenyl] benzoate CAS Name: benzoic acid [2-bromo-4-[(4-methylphenyl)sulfonylamino]phenyl] ester IUPAC Name: [2-bromo-4-[(4-methylphenyl)sulfonylamino]phenyl] benzoate Traditional Name: benzoic acid [2-bromo-4-(tosylamino)phenyl] ester Formula: C20H16BrNO4S MolecularWeight: 446.31434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3)Br

InChI

InChI=1S/C20H16BrNO4S/c1-14-7-10-17(11-8-14)27(24,25)22-16-9-12-19(18(21)13-16)26-20(23)15-5-3-2-4-6-15/h2-13,22H,1H3