methyl 1-[4-[4-(5-methylsulfonyloxyindol-1-yl)butyl]phenoxy]cyclopentane-1-carboxylate

Systemtic Name: methyl 1-[4-[4-(5-methylsulfonyloxyindol-1-yl)butyl]phenoxy]cyclopentane-1-carboxylate Openeye Name: methyl 1-[4-[4-(5-methylsulfonyloxyindol-1-yl)butyl]phenoxy]cyclopentanecarboxylate CAS Name: 1-[4-[4-(5-methylsulfonyloxy-1-indolyl)butyl]phenoxy]-1-cyclopentanecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-[4-(5-methylsulfonyloxyindol-1-yl)butyl]phenoxy]cyclopentane-1-carboxylate Traditional Name: 1-[4-[4-(5-methylsulfonyloxyindol-1-yl)butyl]phenoxy]cyclopentanecarboxylic acid methyl ester Formula: C26H31NO6S MolecularWeight: 485.59244

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCC1)OC2=CC=C(C=C2)CCCCN3C=CC4=C3C=CC(=C4)OS(=O)(=O)C

Isomeric SMILES

COC(=O)C1(CCCC1)OC2=CC=C(C=C2)CCCCN3C=CC4=C3C=CC(=C4)OS(=O)(=O)C

InChI

InChI=1S/C26H31NO6S/c1-31-25(28)26(15-4-5-16-26)32-22-10-8-20(9-11-22)7-3-6-17-27-18-14-21-19-23(12-13-24(21)27)33-34(2,29)30/h8-14,18-19H,3-7,15-17H2,1-2H3