3-azanylidene-2-(3-butylpyridin-1-ium-1-yl)prop-2-enenitrile

Systemtic Name: 3-azanylidene-2-(3-butylpyridin-1-ium-1-yl)prop-2-enenitrile Openeye Name: 2-(3-butylpyridin-1-ium-1-yl)-3-imino-prop-2-enenitrile CAS Name: 2-(3-butyl-1-pyridin-1-iumyl)-3-imino-2-propenenitrile IUPAC Name: 2-(3-butylpyridin-1-ium-1-yl)-3-iminoprop-2-enenitrile Traditional Name: 2-(3-butylpyridin-1-ium-1-yl)-3-imino-acrylonitrile Formula: C12H14N3+ MolecularWeight: 200.25966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C[N+](=CC=C1)C(=C=N)C#N

Isomeric SMILES

CCCCC1=C[N+](=CC=C1)C(=C=N)C#N

InChI

InChI=1S/C12H14N3/c1-2-3-5-11-6-4-7-15(10-11)12(8-13)9-14/h4,6-7,10,13H,2-3,5H2,1H3/q+1