3-(3-cyclopentyloxy-4-methoxy-phenyl)sulfonyl-5-(4-phenoxyphenyl)pentanoic acid

Systemtic Name: 3-(3-cyclopentyloxy-4-methoxy-phenyl)sulfonyl-5-(4-phenoxyphenyl)pentanoic acid Openeye Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]sulfonyl-5-(4-phenoxyphenyl)pentanoic acid CAS Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)sulfonyl-5-(4-phenoxyphenyl)pentanoic acid IUPAC Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)sulfonyl-5-(4-phenoxyphenyl)pentanoic acid Traditional Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]sulfonyl-5-(4-phenoxyphenyl)valeric acid Formula: C29H32O7S MolecularWeight: 524.62518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)C(CCC2=CC=C(C=C2)OC3=CC=CC=C3)CC(=O)O)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)C(CCC2=CC=C(C=C2)OC3=CC=CC=C3)CC(=O)O)OC4CCCC4

InChI

InChI=1S/C29H32O7S/c1-34-27-18-17-25(19-28(27)36-23-9-5-6-10-23)37(32,33)26(20-29(30)31)16-13-21-11-14-24(15-12-21)35-22-7-3-2-4-8-22/h2-4,7-8,11-12,14-15,17-19,23,26H,5-6,9-10,13,16,20H2,1H3,(H,30,31)