N3-fluoranthen-1-ylchrysene-3,6-diamine

Systemtic Name: N3-fluoranthen-1-ylchrysene-3,6-diamine Openeye Name: N3-fluoranthen-1-ylchrysene-3,6-diamine CAS Name: N3-(1-fluoranthenyl)chrysene-3,6-diamine IUPAC Name: 3-N-fluoranthen-1-ylchrysene-3,6-diamine Traditional Name: (6-aminochrysen-3-yl)-fluoranthen-1-yl-amine Formula: C34H22N2 MolecularWeight: 458.55188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C=C2N)C4=C(C=CC(=C4)NC5=C6C7=CC=CC=C7C8=CC=CC(=C86)C=C5)C=C3

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C=C2N)C4=C(C=CC(=C4)NC5=C6C7=CC=CC=C7C8=CC=CC(=C86)C=C5)C=C3

InChI

InChI=1S/C34H22N2/c35-31-19-30-25(23-7-1-3-9-26(23)31)16-13-20-12-15-22(18-29(20)30)36-32-17-14-21-6-5-11-27-24-8-2-4-10-28(24)34(32)33(21)27/h1-19,36H,35H2