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9-methoxy-1,2-dihydrobenzo[j]aceanthrylene

9-methoxy-1,2-dihydrobenzo[j]aceanthrylene

Systemtic Name:9-methoxy-1,2-dihydrobenzo[j]aceanthrylene
Openeye Name:9-methoxy-1,2-dihydrobenzo[j]aceanthrylene
CAS Name:9-methoxy-1,2-dihydrobenzo[j]aceanthrylene
IUPAC Name:9-methoxy-1,2-dihydrobenzo[j]aceanthrylene
Traditional Name:9-methoxycholanthrene
Formula: C21H16O
MolecularWeight: 284.35114
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(C=C2)C4=C5C(=CC=CC5=C3)CC4


Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(C=C2)C4=C5C(=CC=CC5=C3)CC4


InChI

InChI=1S/C21H16O/c1-22-16-7-10-17-14(11-16)6-8-18-19-9-5-13-3-2-4-15(21(13)19)12-20(17)18/h2-4,6-8,10-12H,5,9H2,1H3


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