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benzo[b]pyrene-6-carbonitrile

benzo[b]pyrene-6-carbonitrile

Systemtic Name:benzo[b]pyrene-6-carbonitrile
Openeye Name:benzo[b]pyrene-6-carbonitrile
CAS Name:6-benzo[b]pyrenecarbonitrile
IUPAC Name:benzo[b]pyrene-6-carbonitrile
Traditional Name:benzo[b]pyrene-6-carbonitrile
Formula: C21H11N
MolecularWeight: 277.31874
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C4C(=C2C#N)C=CC5=C4C(=CC=C5)C=C3


Isomeric SMILES

C1=CC=C2C(=C1)C3=C4C(=C2C#N)C=CC5=C4C(=CC=C5)C=C3


InChI

InChI=1S/C21H11N/c22-12-19-16-7-2-1-6-15(16)17-10-8-13-4-3-5-14-9-11-18(19)21(17)20(13)14/h1-11H


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