8-methanidylbenzo[a]pyrene

Systemtic Name: 8-methanidylbenzo[a]pyrene Openeye Name: 8-methanidylbenzo[a]pyrene CAS Name: 8-methanidylbenzo[a]pyrene IUPAC Name: 8-methanidylbenzo[a]pyrene Traditional Name: 8-methanidylbenzo[a]pyrene Formula: C21H13- MolecularWeight: 265.32792

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Descriptors Computed from Structure

Canonical SMILES:

[CH2-]C1=CC2=C(C=C1)C3=C4C(=C2)C=CC5=C4C(=CC=C5)C=C3

Isomeric SMILES

[CH2-]C1=CC2=C(C=C1)C3=C4C(=C2)C=CC5=C4C(=CC=C5)C=C3

InChI

InChI=1S/C21H13/c1-13-5-9-18-17(11-13)12-16-7-6-14-3-2-4-15-8-10-19(18)21(16)20(14)15/h2-12H,1H2/q-1