5-(4-methylphenyl)-3,6,7,8-tetrahydro-2H-azulen-1-one

Systemtic Name: 5-(4-methylphenyl)-3,6,7,8-tetrahydro-2H-azulen-1-one Openeye Name: 5-(p-tolyl)-3,6,7,8-tetrahydro-2H-azulen-1-one CAS Name: 5-(4-methylphenyl)-3,6,7,8-tetrahydro-2H-azulen-1-one IUPAC Name: 5-(4-methylphenyl)-3,6,7,8-tetrahydro-2H-azulen-1-one Traditional Name: 5-(p-tolyl)-3,6,7,8-tetrahydro-2H-azulen-1-one Formula: C17H18O MolecularWeight: 238.32422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(CCC2)C(=O)CC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(CCC2)C(=O)CC3

InChI

InChI=1S/C17H18O/c1-12-5-7-13(8-6-12)14-3-2-4-16-15(11-14)9-10-17(16)18/h5-8,11H,2-4,9-10H2,1H3