2-azanyl-6-ethyl-5-methyl-4-(4-propan-2-ylphenyl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-6-ethyl-5-methyl-4-(4-propan-2-ylphenyl)pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-6-ethyl-4-(4-isopropylphenyl)-5-methyl-pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-6-ethyl-5-methyl-4-(4-propan-2-ylphenyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-amino-6-ethyl-5-methyl-4-(4-propan-2-ylphenyl)pyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-6-ethyl-5-methyl-4-p-cumenyl-pyridin-1-ium-3-carbonitrile Formula: C18H22N3+ MolecularWeight: 280.38738

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C(=[NH+]1)N)C#N)C2=CC=C(C=C2)C(C)C)C

Isomeric SMILES

CCC1=C(C(=C(C(=[NH+]1)N)C#N)C2=CC=C(C=C2)C(C)C)C

InChI

InChI=1S/C18H21N3/c1-5-16-12(4)17(15(10-19)18(20)21-16)14-8-6-13(7-9-14)11(2)3/h6-9,11H,5H2,1-4H3,(H2,20,21)/p+1