7-methyl-3-(4-methylpiperazin-4-ium-1-yl)-1-phenylazanyl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile

Systemtic Name: 7-methyl-3-(4-methylpiperazin-4-ium-1-yl)-1-phenylazanyl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Openeye Name: 1-anilino-7-methyl-3-(4-methylpiperazin-4-ium-1-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile CAS Name: 1-anilino-7-methyl-3-(4-methyl-1-piperazin-4-iumyl)-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile IUPAC Name: 1-anilino-7-methyl-3-(4-methylpiperazin-4-ium-1-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Traditional Name: 1-anilino-7-methyl-3-(4-methylpiperazin-4-ium-1-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Formula: C21H29N6+3 MolecularWeight: 365.49516

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=[NH+]C(=C3C[NH+](CCC3=C2C#N)C)NC4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=[NH+]C(=C3C[NH+](CCC3=C2C#N)C)NC4=CC=CC=C4

InChI

InChI=1S/C21H26N6/c1-25-10-12-27(13-11-25)21-18(14-22)17-8-9-26(2)15-19(17)20(24-21)23-16-6-4-3-5-7-16/h3-7H,8-13,15H2,1-2H3,(H,23,24)/p+3