1,8-bis(azanyl)-6-ethoxy-5-[(4-methylphenyl)methyl]-3-piperidin-1-yl-2,7-naphthyridin-7-ium-4-carbonitrile

Systemtic Name: 1,8-bis(azanyl)-6-ethoxy-5-[(4-methylphenyl)methyl]-3-piperidin-1-yl-2,7-naphthyridin-7-ium-4-carbonitrile Openeye Name: 1,8-diamino-6-ethoxy-3-(1-piperidyl)-5-(p-tolylmethyl)-2,7-naphthyridin-7-ium-4-carbonitrile CAS Name: 1,8-diamino-6-ethoxy-5-[(4-methylphenyl)methyl]-3-(1-piperidinyl)-2,7-naphthyridin-7-ium-4-carbonitrile IUPAC Name: 1,8-diamino-6-ethoxy-5-[(4-methylphenyl)methyl]-3-piperidin-1-yl-2,7-naphthyridin-7-ium-4-carbonitrile Traditional Name: 1,8-diamino-6-ethoxy-5-(4-methylbenzyl)-3-piperidino-2,7-naphthyridin-7-ium-4-carbonitrile Formula: C24H29N6O+ MolecularWeight: 417.52666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=C(C(=NC(=C2C(=[NH+]1)N)N)N3CCCCC3)C#N)CC4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=C(C2=C(C(=NC(=C2C(=[NH+]1)N)N)N3CCCCC3)C#N)CC4=CC=C(C=C4)C

InChI

InChI=1S/C24H28N6O/c1-3-31-24-17(13-16-9-7-15(2)8-10-16)19-18(14-25)23(30-11-5-4-6-12-30)28-21(26)20(19)22(27)29-24/h7-10H,3-6,11-13H2,1-2H3,(H2,26,28)(H2,27,29)/p+1