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7-methylbenzo[a]pyren-3-ol

7-methylbenzo[a]pyren-3-ol

Systemtic Name:7-methylbenzo[a]pyren-3-ol
Openeye Name:7-methylbenzo[a]pyren-3-ol
CAS Name:7-methyl-3-benzo[a]pyrenol
IUPAC Name:7-methylbenzo[a]pyren-3-ol
Traditional Name:7-methylbenzo[a]pyren-3-ol
Formula: C21H14O
MolecularWeight: 282.33526
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C=C3C=CC4=C(C=CC5=C4C3=C2C=C5)O


Isomeric SMILES

CC1=CC=CC2=C1C=C3C=CC4=C(C=CC5=C4C3=C2C=C5)O


InChI

InChI=1S/C21H14O/c1-12-3-2-4-15-16-8-5-13-7-10-19(22)17-9-6-14(11-18(12)15)21(16)20(13)17/h2-11,22H,1H3


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