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

Systemtic Name: 1-(1H-indazol-5-yl)-1-[(3-nitrophenyl)methyl]piperidin-1-ium-4-amine Openeye Name: 1-(1H-indazol-5-yl)-1-[(3-nitrophenyl)methyl]piperidin-1-ium-4-amine CAS Name: 1-(1H-indazol-5-yl)-1-[(3-nitrophenyl)methyl]-4-piperidin-1-iumamine IUPAC Name: 1-(1H-indazol-5-yl)-1-[(3-nitrophenyl)methyl]piperidin-1-ium-4-amine Traditional Name: [1-(1H-indazol-5-yl)-1-(3-nitrobenzyl)piperidin-1-ium-4-yl]amine Formula: C19H22N5O2+ MolecularWeight: 352.41028

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCC1N)(CC2=CC(=CC=C2)[N+](=O)[O-])C3=CC4=C(C=C3)NN=C4

Isomeric SMILES

C1C[N+](CCC1N)(CC2=CC(=CC=C2)[N+](=O)[O-])C3=CC4=C(C=C3)NN=C4

InChI

InChI=1S/C19H22N5O2/c20-16-6-8-24(9-7-16,13-14-2-1-3-17(10-14)23(25)26)18-4-5-19-15(11-18)12-21-22-19/h1-5,10-12,16H,6-9,13,20H2,(H,21,22)/q+1