1-(1H-indazol-5-yl)-1-(1-phenylethyl)piperidin-1-ium-3-amine

Systemtic Name: 1-(1H-indazol-5-yl)-1-(1-phenylethyl)piperidin-1-ium-3-amine Openeye Name: 1-(1H-indazol-5-yl)-1-(1-phenylethyl)piperidin-1-ium-3-amine CAS Name: 1-(1H-indazol-5-yl)-1-(1-phenylethyl)-3-piperidin-1-iumamine IUPAC Name: 1-(1H-indazol-5-yl)-1-(1-phenylethyl)piperidin-1-ium-3-amine Traditional Name: [1-(1H-indazol-5-yl)-1-(1-phenylethyl)piperidin-1-ium-3-yl]amine Formula: C20H25N4+ MolecularWeight: 321.4393

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N4/c1-15(16-6-3-2-4-7-16)24(11-5-8-18(21)14-24)19-9-10-20-17(12-19)13-22-23-20/h2-4,6-7,9-10,12-13,15,18H,5,8,11,14,21H2,1H3,(H,22,23)/q+1