9-(3-methoxy-4-phenylmethoxy-phenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione

Systemtic Name: 9-(3-methoxy-4-phenylmethoxy-phenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione Openeye Name: 9-(4-benzyloxy-3-methoxy-phenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione CAS Name: 9-(3-methoxy-4-phenylmethoxyphenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione IUPAC Name: 9-(3-methoxy-4-phenylmethoxyphenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione Traditional Name: 9-(4-benzoxy-3-methoxy-phenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-quinone Formula: C27H26O5 MolecularWeight: 430.49234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4)OCC5=CC=CC=C5

InChI

InChI=1S/C27H26O5/c1-30-24-15-18(13-14-21(24)31-16-17-7-3-2-4-8-17)25-26-19(28)9-5-11-22(26)32-23-12-6-10-20(29)27(23)25/h2-4,7-8,13-15,25H,5-6,9-12,16H2,1H3