N,N'-bis(quinolin-3-ylmethyl)octane-1,8-diamine

Systemtic Name: N,N'-bis(quinolin-3-ylmethyl)octane-1,8-diamine Openeye Name: N,N'-bis(3-quinolylmethyl)octane-1,8-diamine CAS Name: N,N'-bis(3-quinolinylmethyl)octane-1,8-diamine IUPAC Name: N,N'-bis(quinolin-3-ylmethyl)octane-1,8-diamine Traditional Name: 3-quinolylmethyl-[8-(3-quinolylmethylamino)octyl]amine Formula: C28H34N4 MolecularWeight: 426.59636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)CNCCCCCCCCNCC3=CC4=CC=CC=C4N=C3

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)CNCCCCCCCCNCC3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C28H34N4/c1(3-9-15-29-19-23-17-25-11-5-7-13-27(25)31-21-23)2-4-10-16-30-20-24-18-26-12-6-8-14-28(26)32-22-24/h5-8,11-14,17-18,21-22,29-30H,1-4,9-10,15-16,19-20H2