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

Systemtic Name: 9-(4-octoxyphenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione Openeye Name: 9-(4-octoxyphenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione CAS Name: 9-(4-octoxyphenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione IUPAC Name: 9-(4-octoxyphenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione Traditional Name: 9-(4-octoxyphenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-quinone Formula: C27H34O4 MolecularWeight: 422.55646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4

InChI

InChI=1S/C27H34O4/c1-2-3-4-5-6-7-18-30-20-16-14-19(15-17-20)25-26-21(28)10-8-12-23(26)31-24-13-9-11-22(29)27(24)25/h14-17,25H,2-13,18H2,1H3