4-(azepan-1-yl)-6-morpholin-4-yl-N-phenyl-1,3,5-triazin-5-ium-2-amine

Systemtic Name: 4-(azepan-1-yl)-6-morpholin-4-yl-N-phenyl-1,3,5-triazin-5-ium-2-amine Openeye Name: 4-(azepan-1-yl)-6-morpholino-N-phenyl-1,3,5-triazin-5-ium-2-amine CAS Name: 4-(1-azepanyl)-6-(4-morpholinyl)-N-phenyl-1,3,5-triazin-5-ium-2-amine IUPAC Name: 4-(azepan-1-yl)-6-morpholin-4-yl-N-phenyl-1,3,5-triazin-5-ium-2-amine Traditional Name: [4-(azepan-1-yl)-6-morpholino-s-triazin-5-ium-2-yl]-phenyl-amine Formula: C19H27N6O+ MolecularWeight: 355.45728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=[NH+]C(=NC(=N2)NC3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

C1CCCN(CC1)C2=[NH+]C(=NC(=N2)NC3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C19H26N6O/c1-2-7-11-24(10-6-1)18-21-17(20-16-8-4-3-5-9-16)22-19(23-18)25-12-14-26-15-13-25/h3-5,8-9H,1-2,6-7,10-15H2,(H,20,21,22,23)/p+1