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

Systemtic Name: 2-azanyl-6-phenyl-4-(3,4,5-trimethoxyphenyl)pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-6-phenyl-4-(3,4,5-trimethoxyphenyl)pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-6-phenyl-4-(3,4,5-trimethoxyphenyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-amino-6-phenyl-4-(3,4,5-trimethoxyphenyl)pyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-6-phenyl-4-(3,4,5-trimethoxyphenyl)pyridin-1-ium-3-carbonitrile Formula: C21H20N3O3+ MolecularWeight: 362.4018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=CC(=[NH+]C(=C2C#N)N)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=CC(=[NH+]C(=C2C#N)N)C3=CC=CC=C3

InChI

InChI=1S/C21H19N3O3/c1-25-18-9-14(10-19(26-2)20(18)27-3)15-11-17(13-7-5-4-6-8-13)24-21(23)16(15)12-22/h4-11H,1-3H3,(H2,23,24)/p+1