6-(4-methoxyphenyl)-2-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]amino]pyridine-3-carbonitrile

Systemtic Name: 6-(4-methoxyphenyl)-2-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]amino]pyridine-3-carbonitrile Openeye Name: 6-(4-methoxyphenyl)-2-[4-(4-methylpiperazin-4-ium-1-yl)anilino]pyridine-3-carbonitrile CAS Name: 6-(4-methoxyphenyl)-2-[4-(4-methyl-1-piperazin-4-iumyl)anilino]-3-pyridinecarbonitrile IUPAC Name: 6-(4-methoxyphenyl)-2-[4-(4-methylpiperazin-4-ium-1-yl)anilino]pyridine-3-carbonitrile Traditional Name: 6-(4-methoxyphenyl)-2-[4-(4-methylpiperazin-4-ium-1-yl)anilino]nicotinonitrile Formula: C24H26N5O+ MolecularWeight: 400.49614

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC3=C(C=CC(=N3)C4=CC=C(C=C4)OC)C#N

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC3=C(C=CC(=N3)C4=CC=C(C=C4)OC)C#N

InChI

InChI=1S/C24H25N5O/c1-28-13-15-29(16-14-28)21-8-6-20(7-9-21)26-24-19(17-25)5-12-23(27-24)18-3-10-22(30-2)11-4-18/h3-12H,13-16H2,1-2H3,(H,26,27)/p+1