2-(2-chloranyl-9H-xanthen-9-yl)-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-(2-chloranyl-9H-xanthen-9-yl)-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-(2-chloro-9H-xanthen-9-yl)-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-(2-chloro-9H-xanthen-9-yl)-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-(2-chloro-9H-xanthen-9-yl)-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-(2-chloro-9H-xanthen-9-yl)-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C21H19ClO3 MolecularWeight: 354.82676

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C2C3=CC=CC=C3OC4=C2C=C(C=C4)Cl)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C2C3=CC=CC=C3OC4=C2C=C(C=C4)Cl)C

InChI

InChI=1S/C21H19ClO3/c1-21(2)10-15(23)20(16(24)11-21)19-13-5-3-4-6-17(13)25-18-8-7-12(22)9-14(18)19/h3-9,19-20H,10-11H2,1-2H3