3-methyl-3-phenyl-3a,4,5,6,7,7a-hexahydroindene-1,2-dione

Systemtic Name: 3-methyl-3-phenyl-3a,4,5,6,7,7a-hexahydroindene-1,2-dione Openeye Name: 3-methyl-3-phenyl-3a,4,5,6,7,7a-hexahydroindene-1,2-dione CAS Name: 3-methyl-3-phenyl-3a,4,5,6,7,7a-hexahydroindene-1,2-dione IUPAC Name: 3-methyl-3-phenyl-3a,4,5,6,7,7a-hexahydroindene-1,2-dione Traditional Name: 3-methyl-3-phenyl-3a,4,5,6,7,7a-hexahydroindene-1,2-quinone Formula: C16H18O2 MolecularWeight: 242.31292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCCCC2C(=O)C1=O)C3=CC=CC=C3

Isomeric SMILES

CC1(C2CCCCC2C(=O)C1=O)C3=CC=CC=C3

InChI

InChI=1S/C16H18O2/c1-16(11-7-3-2-4-8-11)13-10-6-5-9-12(13)14(17)15(16)18/h2-4,7-8,12-13H,5-6,9-10H2,1H3