6-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(3-cyclopentyloxy-4-methoxy-phenyl)sulfonyl-hexanoic acid

Systemtic Name: 6-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(3-cyclopentyloxy-4-methoxy-phenyl)sulfonyl-hexanoic acid Openeye Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]sulfonyl-6-(1,3-dioxoisoindolin-2-yl)hexanoic acid CAS Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)sulfonyl-6-(1,3-dioxo-2-isoindolyl)hexanoic acid IUPAC Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)sulfonyl-6-(1,3-dioxoisoindol-2-yl)hexanoic acid Traditional Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]sulfonyl-6-phthalimido-hexanoic acid Formula: C26H29NO8S MolecularWeight: 515.57536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)C(CCCN2C(=O)C3=CC=CC=C3C2=O)CC(=O)O)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)C(CCCN2C(=O)C3=CC=CC=C3C2=O)CC(=O)O)OC4CCCC4

InChI

InChI=1S/C26H29NO8S/c1-34-22-13-12-19(15-23(22)35-17-7-2-3-8-17)36(32,33)18(16-24(28)29)9-6-14-27-25(30)20-10-4-5-11-21(20)26(27)31/h4-5,10-13,15,17-18H,2-3,6-9,14,16H2,1H3,(H,28,29)