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6-ethoxybenzo[a]pyren-1-ol

6-ethoxybenzo[a]pyren-1-ol

Systemtic Name:6-ethoxybenzo[a]pyren-1-ol
Openeye Name:6-ethoxybenzo[a]pyren-1-ol
CAS Name:6-ethoxy-1-benzo[a]pyrenol
IUPAC Name:6-ethoxybenzo[a]pyren-1-ol
Traditional Name:6-ethoxybenzo[a]pyren-1-ol
Formula: C22H16O2
MolecularWeight: 312.36124
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C=CC3=C4C2=C(C=CC4=C(C=C3)O)C5=CC=CC=C51


Isomeric SMILES

CCOC1=C2C=CC3=C4C2=C(C=CC4=C(C=C3)O)C5=CC=CC=C51


InChI

InChI=1S/C22H16O2/c1-2-24-22-16-6-4-3-5-14(16)15-10-11-17-19(23)12-8-13-7-9-18(22)21(15)20(13)17/h3-12,23H,2H2,1H3


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