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benzo[a]pyren-1-ylmethanol

benzo[a]pyren-1-ylmethanol

Systemtic Name:benzo[a]pyren-1-ylmethanol
Openeye Name:benzo[a]pyren-1-ylmethanol
CAS Name:1-benzo[a]pyrenylmethanol
IUPAC Name:benzo[a]pyren-1-ylmethanol
Traditional Name:benzo[a]pyren-1-ylmethanol
Formula: C21H14O
MolecularWeight: 282.33526
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=C(C=C5)CO)C=C3


Isomeric SMILES

C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=C(C=C5)CO)C=C3


InChI

InChI=1S/C21H14O/c22-12-16-8-6-13-5-7-15-11-14-3-1-2-4-17(14)19-10-9-18(16)20(13)21(15)19/h1-11,22H,12H2


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