2-azanyl-6-(4-chlorophenyl)-4-(3,4-dimethoxyphenyl)-5-pentyl-pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-6-(4-chlorophenyl)-4-(3,4-dimethoxyphenyl)-5-pentyl-pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-6-(4-chlorophenyl)-4-(3,4-dimethoxyphenyl)-5-pentyl-pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-6-(4-chlorophenyl)-4-(3,4-dimethoxyphenyl)-5-pentyl-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-amino-6-(4-chlorophenyl)-4-(3,4-dimethoxyphenyl)-5-pentylpyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-5-amyl-6-(4-chlorophenyl)-4-(3,4-dimethoxyphenyl)pyridin-1-ium-3-carbonitrile Formula: C25H27ClN3O2+ MolecularWeight: 436.95378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C([NH+]=C(C(=C1C2=CC(=C(C=C2)OC)OC)C#N)N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCCC1=C([NH+]=C(C(=C1C2=CC(=C(C=C2)OC)OC)C#N)N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H26ClN3O2/c1-4-5-6-7-19-23(17-10-13-21(30-2)22(14-17)31-3)20(15-27)25(28)29-24(19)16-8-11-18(26)12-9-16/h8-14H,4-7H2,1-3H3,(H2,28,29)/p+1