4,6-dimethyl-5-nitro-2-(pentadecylamino)pyridin-1-ium-3-carbonitrile

Systemtic Name: 4,6-dimethyl-5-nitro-2-(pentadecylamino)pyridin-1-ium-3-carbonitrile Openeye Name: 4,6-dimethyl-5-nitro-2-(pentadecylamino)pyridin-1-ium-3-carbonitrile CAS Name: 4,6-dimethyl-5-nitro-2-(pentadecylamino)-3-pyridin-1-iumcarbonitrile IUPAC Name: 4,6-dimethyl-5-nitro-2-(pentadecylamino)pyridin-1-ium-3-carbonitrile Traditional Name: 4,6-dimethyl-5-nitro-2-(pentadecylamino)pyridin-1-ium-3-carbonitrile Formula: C23H39N4O2+ MolecularWeight: 403.58136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCNC1=[NH+]C(=C(C(=C1C#N)C)[N+](=O)[O-])C

Isomeric SMILES

CCCCCCCCCCCCCCCNC1=[NH+]C(=C(C(=C1C#N)C)[N+](=O)[O-])C

InChI

InChI=1S/C23H38N4O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25-23-21(18-24)19(2)22(27(28)29)20(3)26-23/h4-17H2,1-3H3,(H,25,26)/p+1