7,7-dimethyl-3-octyl-8,9-dihydro-6H-benzo[7]annulen-5-one

Systemtic Name: 7,7-dimethyl-3-octyl-8,9-dihydro-6H-benzo[7]annulen-5-one Openeye Name: 7,7-dimethyl-3-octyl-8,9-dihydro-6H-benzo[7]annulen-5-one CAS Name: 7,7-dimethyl-3-octyl-8,9-dihydro-6H-benzo[7]annulen-5-one IUPAC Name: 7,7-dimethyl-3-octyl-8,9-dihydro-6H-benzo[7]annulen-5-one Traditional Name: 7,7-dimethyl-3-octyl-8,9-dihydro-6H-benzocyclohepten-5-one Formula: C21H32O MolecularWeight: 300.47818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC2=C(CCC(CC2=O)(C)C)C=C1

Isomeric SMILES

CCCCCCCCC1=CC2=C(CCC(CC2=O)(C)C)C=C1

InChI

InChI=1S/C21H32O/c1-4-5-6-7-8-9-10-17-11-12-18-13-14-21(2,3)16-20(22)19(18)15-17/h11-12,15H,4-10,13-14,16H2,1-3H3