2-(furan-2-ylmethylamino)-4-(methoxymethyl)-6-methyl-5-nitro-pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-(furan-2-ylmethylamino)-4-(methoxymethyl)-6-methyl-5-nitro-pyridin-1-ium-3-carbonitrile Openeye Name: 2-(2-furylmethylamino)-4-(methoxymethyl)-6-methyl-5-nitro-pyridin-1-ium-3-carbonitrile CAS Name: 2-(2-furanylmethylamino)-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-(furan-2-ylmethylamino)-4-(methoxymethyl)-6-methyl-5-nitropyridin-1-ium-3-carbonitrile Traditional Name: 2-(2-furfurylamino)-4-(methoxymethyl)-6-methyl-5-nitro-pyridin-1-ium-3-carbonitrile Formula: C14H15N4O4+ MolecularWeight: 303.2933

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=[NH+]1)NCC2=CC=CO2)C#N)COC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=C(C(=[NH+]1)NCC2=CC=CO2)C#N)COC)[N+](=O)[O-]

InChI

InChI=1S/C14H14N4O4/c1-9-13(18(19)20)12(8-21-2)11(6-15)14(17-9)16-7-10-4-3-5-22-10/h3-5H,7-8H2,1-2H3,(H,16,17)/p+1