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

Systemtic Name: 5-[1-(1H-indol-3-yl)ethoxy]-3-(6-oxidanylhexoxy)-6-phenylmethoxy-cyclohexane-1,2,4-triol Openeye Name: 6-benzyloxy-3-(6-hydroxyhexoxy)-5-[1-(1H-indol-3-yl)ethoxy]cyclohexane-1,2,4-triol CAS Name: 3-(6-hydroxyhexoxy)-5-[1-(1H-indol-3-yl)ethoxy]-6-phenylmethoxycyclohexane-1,2,4-triol IUPAC Name: 3-(6-hydroxyhexoxy)-5-[1-(1H-indol-3-yl)ethoxy]-6-phenylmethoxycyclohexane-1,2,4-triol Traditional Name: 6-benzoxy-3-(6-hydroxyhexoxy)-5-[1-(1H-indol-3-yl)ethoxy]cyclohexane-1,2,4-triol Formula: C29H39NO7 MolecularWeight: 513.62246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CNC2=CC=CC=C21)OC3C(C(C(C(C3OCC4=CC=CC=C4)O)O)OCCCCCCO)O

Isomeric SMILES

CC(C1=CNC2=CC=CC=C21)OC3C(C(C(C(C3OCC4=CC=CC=C4)O)O)OCCCCCCO)O

InChI

InChI=1S/C29H39NO7/c1-19(22-17-30-23-14-8-7-13-21(22)23)37-29-26(34)27(35-16-10-3-2-9-15-31)24(32)25(33)28(29)36-18-20-11-5-4-6-12-20/h4-8,11-14,17,19,24-34H,2-3,9-10,15-16,18H2,1H3