2-azanyl-5-ethanoyl-6-methyl-4-pyridin-1-ium-3-yl-4H-pyran-3-carbonitrile

Systemtic Name: 2-azanyl-5-ethanoyl-6-methyl-4-pyridin-1-ium-3-yl-4H-pyran-3-carbonitrile Openeye Name: 5-acetyl-2-amino-6-methyl-4-pyridin-1-ium-3-yl-4H-pyran-3-carbonitrile CAS Name: 5-acetyl-2-amino-6-methyl-4-(3-pyridin-1-iumyl)-4H-pyran-3-carbonitrile IUPAC Name: 5-acetyl-2-amino-6-methyl-4-pyridin-1-ium-3-yl-4H-pyran-3-carbonitrile Traditional Name: 5-acetyl-2-amino-6-methyl-4-pyridin-1-ium-3-yl-4H-pyran-3-carbonitrile Formula: C14H14N3O2+ MolecularWeight: 256.27986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(O1)N)C#N)C2=C[NH+]=CC=C2)C(=O)C

Isomeric SMILES

CC1=C(C(C(=C(O1)N)C#N)C2=C[NH+]=CC=C2)C(=O)C

InChI

InChI=1S/C14H13N3O2/c1-8(18)12-9(2)19-14(16)11(6-15)13(12)10-4-3-5-17-7-10/h3-5,7,13H,16H2,1-2H3/p+1