5-chloranyl-9-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-3,3-dimethyl-4,9-dihydro-2H-xanthen-1-one

Systemtic Name: 5-chloranyl-9-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-3,3-dimethyl-4,9-dihydro-2H-xanthen-1-one Openeye Name: 5-chloro-9-(2-hydroxy-4,4-dimethyl-6-oxo-cyclohexen-1-yl)-3,3-dimethyl-4,9-dihydro-2H-xanthen-1-one CAS Name: 5-chloro-9-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)-3,3-dimethyl-4,9-dihydro-2H-xanthen-1-one IUPAC Name: 5-chloro-9-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-3,3-dimethyl-4,9-dihydro-2H-xanthen-1-one Traditional Name: 5-chloro-9-(2-hydroxy-6-keto-4,4-dimethyl-cyclohexen-1-yl)-3,3-dimethyl-4,9-dihydro-2H-xanthen-1-one Formula: C23H25ClO4 MolecularWeight: 400.8952

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C2C3=C(C(=CC=C3)Cl)OC4=C2C(=O)CC(C4)(C)C)O)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C2C3=C(C(=CC=C3)Cl)OC4=C2C(=O)CC(C4)(C)C)O)C

InChI

InChI=1S/C23H25ClO4/c1-22(2)8-14(25)19(15(26)9-22)18-12-6-5-7-13(24)21(12)28-17-11-23(3,4)10-16(27)20(17)18/h5-7,18,25H,8-11H2,1-4H3