2-azanyl-5,6-dimethyl-4-(2,3,4-trimethoxyphenyl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-5,6-dimethyl-4-(2,3,4-trimethoxyphenyl)pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-5,6-dimethyl-4-(2,3,4-trimethoxyphenyl)pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-5,6-dimethyl-4-(2,3,4-trimethoxyphenyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-amino-5,6-dimethyl-4-(2,3,4-trimethoxyphenyl)pyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-5,6-dimethyl-4-(2,3,4-trimethoxyphenyl)pyridin-1-ium-3-carbonitrile Formula: C17H20N3O3+ MolecularWeight: 314.359

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([NH+]=C(C(=C1C2=C(C(=C(C=C2)OC)OC)OC)C#N)N)C

Isomeric SMILES

CC1=C([NH+]=C(C(=C1C2=C(C(=C(C=C2)OC)OC)OC)C#N)N)C

InChI

InChI=1S/C17H19N3O3/c1-9-10(2)20-17(19)12(8-18)14(9)11-6-7-13(21-3)16(23-5)15(11)22-4/h6-7H,1-5H3,(H2,19,20)/p+1