2-chloranyl-6-oxidanyl-3,4,5-tris(phenylmethoxy)-3-(phenylmethoxymethyl)cyclohexan-1-one

Systemtic Name: 2-chloranyl-6-oxidanyl-3,4,5-tris(phenylmethoxy)-3-(phenylmethoxymethyl)cyclohexan-1-one Openeye Name: 3,4,5-tribenzyloxy-3-(benzyloxymethyl)-2-chloro-6-hydroxy-cyclohexanone CAS Name: 2-chloro-6-hydroxy-3,4,5-tris(phenylmethoxy)-3-(phenylmethoxymethyl)-1-cyclohexanone IUPAC Name: 2-chloro-6-hydroxy-3,4,5-tris(phenylmethoxy)-3-(phenylmethoxymethyl)cyclohexan-1-one Traditional Name: 3,4,5-tribenzoxy-3-(benzoxymethyl)-2-chloro-6-hydroxy-cyclohexanone Formula: C35H35ClO6 MolecularWeight: 587.1018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2(C(C(C(C(=O)C2Cl)O)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COCC2(C(C(C(C(=O)C2Cl)O)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C35H35ClO6/c36-33-31(38)30(37)32(40-22-27-15-7-2-8-16-27)34(41-23-28-17-9-3-10-18-28)35(33,42-24-29-19-11-4-12-20-29)25-39-21-26-13-5-1-6-14-26/h1-20,30,32-34,37H,21-25H2