2-(2-chloranyl-6-methyl-4-phenyl-phenyl)-3-oxidanyl-3a,4,5,6,7,7a-hexahydroinden-1-one

Systemtic Name: 2-(2-chloranyl-6-methyl-4-phenyl-phenyl)-3-oxidanyl-3a,4,5,6,7,7a-hexahydroinden-1-one Openeye Name: 2-(2-chloro-6-methyl-4-phenyl-phenyl)-3-hydroxy-3a,4,5,6,7,7a-hexahydroinden-1-one CAS Name: 2-(2-chloro-6-methyl-4-phenylphenyl)-3-hydroxy-3a,4,5,6,7,7a-hexahydroinden-1-one IUPAC Name: 2-(2-chloro-6-methyl-4-phenylphenyl)-3-hydroxy-3a,4,5,6,7,7a-hexahydroinden-1-one Traditional Name: 2-(2-chloro-6-methyl-4-phenyl-phenyl)-3-hydroxy-3a,4,5,6,7,7a-hexahydroinden-1-one Formula: C22H21ClO2 MolecularWeight: 352.85394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C2=CC=CC=C2)Cl)C3=C(C4CCCCC4C3=O)O

Isomeric SMILES

CC1=C(C(=CC(=C1)C2=CC=CC=C2)Cl)C3=C(C4CCCCC4C3=O)O

InChI

InChI=1S/C22H21ClO2/c1-13-11-15(14-7-3-2-4-8-14)12-18(23)19(13)20-21(24)16-9-5-6-10-17(16)22(20)25/h2-4,7-8,11-12,16-17,24H,5-6,9-10H2,1H3