2-azanyl-4-(3,4-dimethoxyphenyl)-6-methyl-5-propyl-pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3,4-dimethoxyphenyl)-6-methyl-5-propyl-pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-4-(3,4-dimethoxyphenyl)-6-methyl-5-propyl-pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-4-(3,4-dimethoxyphenyl)-6-methyl-5-propyl-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-amino-4-(3,4-dimethoxyphenyl)-6-methyl-5-propylpyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-4-(3,4-dimethoxyphenyl)-6-methyl-5-propyl-pyridin-1-ium-3-carbonitrile Formula: C18H22N3O2+ MolecularWeight: 312.38618

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C([NH+]=C(C(=C1C2=CC(=C(C=C2)OC)OC)C#N)N)C

Isomeric SMILES

CCCC1=C([NH+]=C(C(=C1C2=CC(=C(C=C2)OC)OC)C#N)N)C

InChI

InChI=1S/C18H21N3O2/c1-5-6-13-11(2)21-18(20)14(10-19)17(13)12-7-8-15(22-3)16(9-12)23-4/h7-9H,5-6H2,1-4H3,(H2,20,21)/p+1