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2-benzo[b]pyren-6-yloxirane

2-benzo[b]pyren-6-yloxirane

Systemtic Name:2-benzo[b]pyren-6-yloxirane
Openeye Name:2-benzo[b]pyren-6-yloxirane
CAS Name:2-(6-benzo[b]pyrenyl)oxirane
IUPAC Name:2-benzo[b]pyren-6-yloxirane
Traditional Name:2-benzo[b]pyren-6-yloxirane
Formula: C22H14O
MolecularWeight: 294.34596
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Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C6=CC=CC=C62


Isomeric SMILES

C1C(O1)C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C6=CC=CC=C62


InChI

InChI=1S/C22H14O/c1-2-7-16-15(6-1)17-10-8-13-4-3-5-14-9-11-18(22(17)20(13)14)21(16)19-12-23-19/h1-11,19H,12H2


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