benzo[a]pyren-5-amine

Systemtic Name: benzo[a]pyren-5-amine Openeye Name: benzo[a]pyren-5-amine CAS Name: 5-benzo[a]pyrenamine IUPAC Name: benzo[a]pyren-5-amine Traditional Name: benzo[a]pyren-5-ylamine Formula: C20H13N MolecularWeight: 267.32392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C3=C4C(=CC2=C1)C(=CC5=CC=CC(=C54)C=C3)N

Isomeric SMILES

C1=CC=C2C3=C4C(=CC2=C1)C(=CC5=CC=CC(=C54)C=C3)N

InChI

InChI=1S/C20H13N/c21-18-11-14-6-3-5-12-8-9-16-15-7-2-1-4-13(15)10-17(18)20(16)19(12)14/h1-11H,21H2