2-[1-[1-(4-imidazol-1-ylphenyl)carbonylpiperidin-4-yl]-1,2,3-triazol-4-yl]propan-2-ylazanium

Systemtic Name: 2-[1-[1-(4-imidazol-1-ylphenyl)carbonylpiperidin-4-yl]-1,2,3-triazol-4-yl]propan-2-ylazanium Openeye Name: [1-[1-[1-(4-imidazol-1-ylbenzoyl)-4-piperidyl]triazol-4-yl]-1-methyl-ethyl]ammonium CAS Name: 2-[1-[1-[[4-(1-imidazolyl)phenyl]-oxomethyl]-4-piperidinyl]-4-triazolyl]propan-2-ylammonium IUPAC Name: 2-[1-[1-(4-imidazol-1-ylbenzoyl)piperidin-4-yl]triazol-4-yl]propan-2-ylazanium Traditional Name: [1-[1-[1-(4-imidazol-1-ylbenzoyl)-4-piperidyl]triazol-4-yl]-1-methyl-ethyl]ammonium Formula: C20H26N7O+ MolecularWeight: 380.46674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CN(N=N1)C2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C=CN=C4)[NH3+]

Isomeric SMILES

CC(C)(C1=CN(N=N1)C2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C=CN=C4)[NH3+]

InChI

InChI=1S/C20H25N7O/c1-20(2,21)18-13-27(24-23-18)17-7-10-25(11-8-17)19(28)15-3-5-16(6-4-15)26-12-9-22-14-26/h3-6,9,12-14,17H,7-8,10-11,21H2,1-2H3/p+1