1-(1H-indazol-5-yl)-1-[(4-methylphenyl)methyl]piperidin-1-ium-3-amine

Systemtic Name: 1-(1H-indazol-5-yl)-1-[(4-methylphenyl)methyl]piperidin-1-ium-3-amine Openeye Name: 1-(1H-indazol-5-yl)-1-(p-tolylmethyl)piperidin-1-ium-3-amine CAS Name: 1-(1H-indazol-5-yl)-1-[(4-methylphenyl)methyl]-3-piperidin-1-iumamine IUPAC Name: 1-(1H-indazol-5-yl)-1-[(4-methylphenyl)methyl]piperidin-1-ium-3-amine Traditional Name: [1-(1H-indazol-5-yl)-1-(4-methylbenzyl)piperidin-1-ium-3-yl]amine Formula: C20H25N4+ MolecularWeight: 321.4393

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[N+]2(CCCC(C2)N)C3=CC4=C(C=C3)NN=C4

Isomeric SMILES

CC1=CC=C(C=C1)C[N+]2(CCCC(C2)N)C3=CC4=C(C=C3)NN=C4

InChI

InChI=1S/C20H25N4/c1-15-4-6-16(7-5-15)13-24(10-2-3-18(21)14-24)19-8-9-20-17(11-19)12-22-23-20/h4-9,11-12,18H,2-3,10,13-14,21H2,1H3,(H,22,23)/q+1