[cyclopentyloxy-[(E)-(1-methylpyridin-1-ium-2-yl)methylideneamino]oxy-phosphoryl]methanenitrile

Systemtic Name: [cyclopentyloxy-[(E)-(1-methylpyridin-1-ium-2-yl)methylideneamino]oxy-phosphoryl]methanenitrile Openeye Name: [cyclopentoxy-[(E)-(1-methylpyridin-1-ium-2-yl)methyleneamino]oxy-phosphoryl]formonitrile CAS Name: [cyclopentyloxy-[(E)-(1-methyl-2-pyridin-1-iumyl)methylideneamino]oxyphosphoryl]formonitrile IUPAC Name: [cyclopentyloxy-[(E)-(1-methylpyridin-1-ium-2-yl)methylideneamino]oxyphosphoryl]formonitrile Traditional Name: [cyclopentoxy-[(E)-(1-methylpyridin-1-ium-2-yl)methyleneamino]oxy-phosphoryl]formonitrile Formula: C13H17N3O3P+ MolecularWeight: 294.266141

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1C=NOP(=O)(C#N)OC2CCCC2

Isomeric SMILES

C[N+]1=CC=CC=C1/C=N/OP(=O)(C#N)OC2CCCC2

InChI

InChI=1S/C13H17N3O3P/c1-16-9-5-4-6-12(16)10-15-19-20(17,11-14)18-13-7-2-3-8-13/h4-6,9-10,13H,2-3,7-8H2,1H3/q+1/b15-10+