2-azanyl-4-[2,3-bis(chloranyl)phenyl]-6-(2-methylpropyl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-4-[2,3-bis(chloranyl)phenyl]-6-(2-methylpropyl)pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-4-(2,3-dichlorophenyl)-6-isobutyl-pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-4-(2,3-dichlorophenyl)-6-(2-methylpropyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-amino-4-(2,3-dichlorophenyl)-6-(2-methylpropyl)pyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-4-(2,3-dichlorophenyl)-6-isobutyl-pyridin-1-ium-3-carbonitrile Formula: C16H16Cl2N3+ MolecularWeight: 321.22434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=[NH+]C(=C(C(=C1)C2=C(C(=CC=C2)Cl)Cl)C#N)N

Isomeric SMILES

CC(C)CC1=[NH+]C(=C(C(=C1)C2=C(C(=CC=C2)Cl)Cl)C#N)N

InChI

InChI=1S/C16H15Cl2N3/c1-9(2)6-10-7-12(13(8-19)16(20)21-10)11-4-3-5-14(17)15(11)18/h3-5,7,9H,6H2,1-2H3,(H2,20,21)/p+1