N-[3-[4-(4-methylpiperazin-4-ium-1-yl)carbonyl-1,2,3-triazol-1-yl]propyl]-2-naphthalen-1-yl-ethanamide

Systemtic Name: N-[3-[4-(4-methylpiperazin-4-ium-1-yl)carbonyl-1,2,3-triazol-1-yl]propyl]-2-naphthalen-1-yl-ethanamide Openeye Name: N-[3-[4-(4-methylpiperazin-4-ium-1-carbonyl)triazol-1-yl]propyl]-2-(1-naphthyl)acetamide CAS Name: N-[3-[4-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-1-triazolyl]propyl]-2-(1-naphthalenyl)acetamide IUPAC Name: N-[3-[4-(4-methylpiperazin-4-ium-1-carbonyl)triazol-1-yl]propyl]-2-naphthalen-1-ylacetamide Traditional Name: N-[3-[4-(4-methylpiperazin-4-ium-1-carbonyl)triazol-1-yl]propyl]-2-(1-naphthyl)acetamide Formula: C23H29N6O2+ MolecularWeight: 421.51536

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CN(N=N2)CCCNC(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CN(N=N2)CCCNC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H28N6O2/c1-27-12-14-28(15-13-27)23(31)21-17-29(26-25-21)11-5-10-24-22(30)16-19-8-4-7-18-6-2-3-9-20(18)19/h2-4,6-9,17H,5,10-16H2,1H3,(H,24,30)/p+1