3-[(4-bromophenyl)sulfonylamino]-4-(4-methylpiperidin-1-yl)benzoic acid

Systemtic Name: 3-[(4-bromophenyl)sulfonylamino]-4-(4-methylpiperidin-1-yl)benzoic acid Openeye Name: 3-[(4-bromophenyl)sulfonylamino]-4-(4-methyl-1-piperidyl)benzoic acid CAS Name: 3-[(4-bromophenyl)sulfonylamino]-4-(4-methyl-1-piperidinyl)benzoic acid IUPAC Name: 3-[(4-bromophenyl)sulfonylamino]-4-(4-methylpiperidin-1-yl)benzoic acid Traditional Name: 3-(brosylamino)-4-(4-methylpiperidino)benzoic acid Formula: C19H21BrN2O4S MolecularWeight: 453.35004

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H21BrN2O4S/c1-13-8-10-22(11-9-13)18-7-2-14(19(23)24)12-17(18)21-27(25,26)16-5-3-15(20)4-6-16/h2-7,12-13,21H,8-11H2,1H3,(H,23,24)