2-(7,8,9,10-tetrahydrobenzo[b]pyren-6-yl)cyclohexan-1-one

Systemtic Name: 2-(7,8,9,10-tetrahydrobenzo[b]pyren-6-yl)cyclohexan-1-one Openeye Name: 2-(7,8,9,10-tetrahydrobenzo[b]pyren-6-yl)cyclohexanone CAS Name: 2-(7,8,9,10-tetrahydrobenzo[b]pyren-6-yl)-1-cyclohexanone IUPAC Name: 2-(7,8,9,10-tetrahydrobenzo[b]pyren-6-yl)cyclohexan-1-one Traditional Name: 2-(7,8,9,10-tetrahydrobenzo[b]pyren-6-yl)cyclohexanone Formula: C26H24O MolecularWeight: 352.46816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C6=C2CCCC6

Isomeric SMILES

C1CCC(=O)C(C1)C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C6=C2CCCC6

InChI

InChI=1S/C26H24O/c27-23-11-4-3-10-21(23)25-19-9-2-1-8-18(19)20-14-12-16-6-5-7-17-13-15-22(25)26(20)24(16)17/h5-7,12-15,21H,1-4,8-11H2