3-heptoxy-5-[1-(1H-indol-3-yl)ethoxy]-6-phenylmethoxy-cyclohexane-1,2,4-triol

Systemtic Name: 3-heptoxy-5-[1-(1H-indol-3-yl)ethoxy]-6-phenylmethoxy-cyclohexane-1,2,4-triol Openeye Name: 6-benzyloxy-3-heptoxy-5-[1-(1H-indol-3-yl)ethoxy]cyclohexane-1,2,4-triol CAS Name: 3-heptoxy-5-[1-(1H-indol-3-yl)ethoxy]-6-phenylmethoxycyclohexane-1,2,4-triol IUPAC Name: 3-heptoxy-5-[1-(1H-indol-3-yl)ethoxy]-6-phenylmethoxycyclohexane-1,2,4-triol Traditional Name: 6-benzoxy-3-heptoxy-5-[1-(1H-indol-3-yl)ethoxy]cyclohexane-1,2,4-triol Formula: C30H41NO6 MolecularWeight: 511.64964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1C(C(C(C(C1O)OC(C)C2=CNC3=CC=CC=C32)OCC4=CC=CC=C4)O)O

Isomeric SMILES

CCCCCCCOC1C(C(C(C(C1O)OC(C)C2=CNC3=CC=CC=C32)OCC4=CC=CC=C4)O)O

InChI

InChI=1S/C30H41NO6/c1-3-4-5-6-12-17-35-28-25(32)26(33)29(36-19-21-13-8-7-9-14-21)30(27(28)34)37-20(2)23-18-31-24-16-11-10-15-22(23)24/h7-11,13-16,18,20,25-34H,3-6,12,17,19H2,1-2H3