4-pyridin-1-ium-4-ylhepta-1,6-dien-4-ylazanium

Systemtic Name: 4-pyridin-1-ium-4-ylhepta-1,6-dien-4-ylazanium Openeye Name: (1-allyl-1-pyridin-1-ium-4-yl-but-3-enyl)ammonium CAS Name: 4-(4-pyridin-1-iumyl)hepta-1,6-dien-4-ylammonium IUPAC Name: 4-pyridin-1-ium-4-ylhepta-1,6-dien-4-ylazanium Traditional Name: (1-allyl-1-pyridin-1-ium-4-yl-but-3-enyl)ammonium Formula: C12H18N2+2 MolecularWeight: 190.28472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CC=C)(C1=CC=[NH+]C=C1)[NH3+]

Isomeric SMILES

C=CCC(CC=C)(C1=CC=[NH+]C=C1)[NH3+]

InChI

InChI=1S/C12H16N2/c1-3-7-12(13,8-4-2)11-5-9-14-10-6-11/h3-6,9-10H,1-2,7-8,13H2/p+2