N5-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]pyridin-1-ium-2,5-diamine

Systemtic Name: N5-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]pyridin-1-ium-2,5-diamine Openeye Name: N5-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]pyridin-1-ium-2,5-diamine CAS Name: N5-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]pyridin-1-ium-2,5-diamine IUPAC Name: 5-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]pyridin-1-ium-2,5-diamine Traditional Name: (6-aminopyridin-1-ium-3-yl)-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amine Formula: C15H18N3O2+ MolecularWeight: 272.32232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CCNC3=C[NH+]=C(C=C3)N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CCNC3=C[NH+]=C(C=C3)N

InChI

InChI=1S/C15H17N3O2/c16-15-4-2-12(10-18-15)17-6-5-11-1-3-13-14(9-11)20-8-7-19-13/h1-4,9-10,17H,5-8H2,(H2,16,18)/p+1