[1-[1-[(3-phenyl-1H-pyrazol-5-yl)carbonyl]piperidin-4-yl]-1,2,3-triazol-4-yl]methylazanium

Systemtic Name: [1-[1-[(3-phenyl-1H-pyrazol-5-yl)carbonyl]piperidin-4-yl]-1,2,3-triazol-4-yl]methylazanium Openeye Name: [1-[1-(3-phenyl-1H-pyrazole-5-carbonyl)-4-piperidyl]triazol-4-yl]methylammonium CAS Name: [1-[1-[oxo-(3-phenyl-1H-pyrazol-5-yl)methyl]-4-piperidinyl]-4-triazolyl]methylammonium IUPAC Name: [1-[1-(3-phenyl-1H-pyrazole-5-carbonyl)piperidin-4-yl]triazol-4-yl]methylazanium Traditional Name: [1-[1-(3-phenyl-1H-pyrazole-5-carbonyl)-4-piperidyl]triazol-4-yl]methylammonium Formula: C18H22N7O+ MolecularWeight: 352.41358

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C=C(N=N2)C[NH3+])C(=O)C3=CC(=NN3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1N2C=C(N=N2)C[NH3+])C(=O)C3=CC(=NN3)C4=CC=CC=C4

InChI

InChI=1S/C18H21N7O/c19-11-14-12-25(23-20-14)15-6-8-24(9-7-15)18(26)17-10-16(21-22-17)13-4-2-1-3-5-13/h1-5,10,12,15H,6-9,11,19H2,(H,21,22)/p+1