2-azanyl-4-(3-ethoxy-4-oxidanyl-phenyl)-6-(4-ethoxyphenyl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-ethoxy-4-oxidanyl-phenyl)-6-(4-ethoxyphenyl)pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-4-(3-ethoxy-4-hydroxy-phenyl)-6-(4-ethoxyphenyl)pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-4-(3-ethoxy-4-hydroxyphenyl)-6-(4-ethoxyphenyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-amino-4-(3-ethoxy-4-hydroxyphenyl)-6-(4-ethoxyphenyl)pyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-4-(3-ethoxy-4-hydroxy-phenyl)-6-p-phenetyl-pyridin-1-ium-3-carbonitrile Formula: C22H22N3O3+ MolecularWeight: 376.42838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=[NH+]C(=C(C(=C2)C3=CC(=C(C=C3)O)OCC)C#N)N

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=[NH+]C(=C(C(=C2)C3=CC(=C(C=C3)O)OCC)C#N)N

InChI

InChI=1S/C22H21N3O3/c1-3-27-16-8-5-14(6-9-16)19-12-17(18(13-23)22(24)25-19)15-7-10-20(26)21(11-15)28-4-2/h5-12,26H,3-4H2,1-2H3,(H2,24,25)/p+1