2-benzo[a]anthracen-1-ylethanenitrile

Systemtic Name: 2-benzo[a]anthracen-1-ylethanenitrile Openeye Name: 2-benzo[a]anthracen-1-ylacetonitrile CAS Name: 2-(1-benzo[a]anthracenyl)acetonitrile IUPAC Name: 2-benzo[a]anthracen-1-ylacetonitrile Traditional Name: 2-benz[a]anthracen-1-ylacetonitrile Formula: C20H13N MolecularWeight: 267.32392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)CC#N

Isomeric SMILES

C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)CC#N

InChI

InChI=1S/C20H13N/c21-11-10-15-7-3-6-14-8-9-18-12-16-4-1-2-5-17(16)13-19(18)20(14)15/h1-9,12-13H,10H2