2-[4-cyclopentyloxy-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-cyclopentyloxy-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]phenyl]ethanoic acid Openeye Name: 2-[4-(cyclopentoxy)-3-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]phenyl]acetic acid CAS Name: 2-[4-cyclopentyloxy-3-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]phenyl]acetic acid IUPAC Name: 2-[4-cyclopentyloxy-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]phenyl]acetic acid Traditional Name: 2-[4-(cyclopentoxy)-3-[(4-tosylpiperazino)methyl]phenyl]acetic acid Formula: C25H32N2O5S MolecularWeight: 472.59698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(C=CC(=C3)CC(=O)O)OC4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(C=CC(=C3)CC(=O)O)OC4CCCC4

InChI

InChI=1S/C25H32N2O5S/c1-19-6-9-23(10-7-19)33(30,31)27-14-12-26(13-15-27)18-21-16-20(17-25(28)29)8-11-24(21)32-22-4-2-3-5-22/h6-11,16,22H,2-5,12-15,17-18H2,1H3,(H,28,29)