5,5-dimethyl-3-oxidanyl-2-(9H-xanthen-9-yl)cyclohex-2-en-1-one

Systemtic Name: 5,5-dimethyl-3-oxidanyl-2-(9H-xanthen-9-yl)cyclohex-2-en-1-one Openeye Name: 3-hydroxy-5,5-dimethyl-2-(9H-xanthen-9-yl)cyclohex-2-en-1-one CAS Name: 3-hydroxy-5,5-dimethyl-2-(9H-xanthen-9-yl)-1-cyclohex-2-enone IUPAC Name: 3-hydroxy-5,5-dimethyl-2-(9H-xanthen-9-yl)cyclohex-2-en-1-one Traditional Name: 3-hydroxy-5,5-dimethyl-2-(9H-xanthen-9-yl)cyclohex-2-en-1-one Formula: C21H20O3 MolecularWeight: 320.3817

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C2C3=CC=CC=C3OC4=CC=CC=C24)O)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C2C3=CC=CC=C3OC4=CC=CC=C24)O)C

InChI

InChI=1S/C21H20O3/c1-21(2)11-15(22)20(16(23)12-21)19-13-7-3-5-9-17(13)24-18-10-6-4-8-14(18)19/h3-10,19,22H,11-12H2,1-2H3