2-[(2-bromanyl-4-methyl-phenyl)sulfonylamino]-3,4,5-trimethoxy-benzoic acid

Systemtic Name: 2-[(2-bromanyl-4-methyl-phenyl)sulfonylamino]-3,4,5-trimethoxy-benzoic acid Openeye Name: 2-[(2-bromo-4-methyl-phenyl)sulfonylamino]-3,4,5-trimethoxy-benzoic acid CAS Name: 2-[(2-bromo-4-methylphenyl)sulfonylamino]-3,4,5-trimethoxybenzoic acid IUPAC Name: 2-[(2-bromo-4-methylphenyl)sulfonylamino]-3,4,5-trimethoxybenzoic acid Traditional Name: 2-[(2-bromo-4-methyl-phenyl)sulfonylamino]-3,4,5-trimethoxy-benzoic acid Formula: C17H18BrNO7S MolecularWeight: 460.29632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NC2=C(C(=C(C=C2C(=O)O)OC)OC)OC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NC2=C(C(=C(C=C2C(=O)O)OC)OC)OC)Br

InChI

InChI=1S/C17H18BrNO7S/c1-9-5-6-13(11(18)7-9)27(22,23)19-14-10(17(20)21)8-12(24-2)15(25-3)16(14)26-4/h5-8,19H,1-4H3,(H,20,21)