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

Systemtic Name: 9-(phenylmethyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione Openeye Name: 9-benzyl-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione CAS Name: 9-(phenylmethyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione IUPAC Name: 9-benzyl-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione Traditional Name: 9-benzyl-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-quinone Formula: C20H20O3 MolecularWeight: 308.371

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C3=C(O2)CCCC3=O)CC4=CC=CC=C4)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C3=C(O2)CCCC3=O)CC4=CC=CC=C4)C(=O)C1

InChI

InChI=1S/C20H20O3/c21-15-8-4-10-17-19(15)14(12-13-6-2-1-3-7-13)20-16(22)9-5-11-18(20)23-17/h1-3,6-7,14H,4-5,8-12H2