9-(1,3-benzodioxol-5-yl)-3-oxidanyl-1-(2-oxidanyl-6-phenylmethoxy-phenyl)nonan-1-one

Systemtic Name: 9-(1,3-benzodioxol-5-yl)-3-oxidanyl-1-(2-oxidanyl-6-phenylmethoxy-phenyl)nonan-1-one Openeye Name: 9-(1,3-benzodioxol-5-yl)-1-(2-benzyloxy-6-hydroxy-phenyl)-3-hydroxy-nonan-1-one CAS Name: 9-(1,3-benzodioxol-5-yl)-3-hydroxy-1-(2-hydroxy-6-phenylmethoxyphenyl)-1-nonanone IUPAC Name: 9-(1,3-benzodioxol-5-yl)-3-hydroxy-1-(2-hydroxy-6-phenylmethoxyphenyl)nonan-1-one Traditional Name: 9-(1,3-benzodioxol-5-yl)-1-(2-benzoxy-6-hydroxy-phenyl)-3-hydroxy-nonan-1-one Formula: C29H32O6 MolecularWeight: 476.56078

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCCCCCC(CC(=O)C3=C(C=CC=C3OCC4=CC=CC=C4)O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCCCCCC(CC(=O)C3=C(C=CC=C3OCC4=CC=CC=C4)O)O

InChI

InChI=1S/C29H32O6/c30-23(12-7-2-1-4-9-21-15-16-26-28(17-21)35-20-34-26)18-25(32)29-24(31)13-8-14-27(29)33-19-22-10-5-3-6-11-22/h3,5-6,8,10-11,13-17,23,30-31H,1-2,4,7,9,12,18-20H2