2-azanyl-5-butyl-4-(3-methoxy-4-oxidanyl-phenyl)-6-phenyl-pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-5-butyl-4-(3-methoxy-4-oxidanyl-phenyl)-6-phenyl-pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-5-butyl-4-(4-hydroxy-3-methoxy-phenyl)-6-phenyl-pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-5-butyl-4-(4-hydroxy-3-methoxyphenyl)-6-phenyl-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-amino-5-butyl-4-(4-hydroxy-3-methoxyphenyl)-6-phenylpyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-5-butyl-4-(4-hydroxy-3-methoxy-phenyl)-6-phenyl-pyridin-1-ium-3-carbonitrile Formula: C23H24N3O2+ MolecularWeight: 374.45556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C([NH+]=C(C(=C1C2=CC(=C(C=C2)O)OC)C#N)N)C3=CC=CC=C3

Isomeric SMILES

CCCCC1=C([NH+]=C(C(=C1C2=CC(=C(C=C2)O)OC)C#N)N)C3=CC=CC=C3

InChI

InChI=1S/C23H23N3O2/c1-3-4-10-17-21(16-11-12-19(27)20(13-16)28-2)18(14-24)23(25)26-22(17)15-8-6-5-7-9-15/h5-9,11-13,27H,3-4,10H2,1-2H3,(H2,25,26)/p+1