4-[4-(4-fluorophenyl)piperazin-1-yl]-3-[(4-methoxyphenyl)sulfonylamino]benzoic acid

Systemtic Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-3-[(4-methoxyphenyl)sulfonylamino]benzoic acid Openeye Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-3-[(4-methoxyphenyl)sulfonylamino]benzoic acid CAS Name: 4-[4-(4-fluorophenyl)-1-piperazinyl]-3-[(4-methoxyphenyl)sulfonylamino]benzoic acid IUPAC Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-3-[(4-methoxyphenyl)sulfonylamino]benzoic acid Traditional Name: 4-[4-(4-fluorophenyl)piperazino]-3-[(4-methoxyphenyl)sulfonylamino]benzoic acid Formula: C24H24FN3O5S MolecularWeight: 485.527863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H24FN3O5S/c1-33-20-7-9-21(10-8-20)34(31,32)26-22-16-17(24(29)30)2-11-23(22)28-14-12-27(13-15-28)19-5-3-18(25)4-6-19/h2-11,16,26H,12-15H2,1H3,(H,29,30)