[1-[1-(3-fluoranyl-4-methyl-phenyl)carbonylpiperidin-4-yl]-1,2,3-triazol-4-yl]methylazanium

Systemtic Name: [1-[1-(3-fluoranyl-4-methyl-phenyl)carbonylpiperidin-4-yl]-1,2,3-triazol-4-yl]methylazanium Openeye Name: [1-[1-(3-fluoro-4-methyl-benzoyl)-4-piperidyl]triazol-4-yl]methylammonium CAS Name: [1-[1-[(3-fluoro-4-methylphenyl)-oxomethyl]-4-piperidinyl]-4-triazolyl]methylammonium IUPAC Name: [1-[1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]triazol-4-yl]methylazanium Traditional Name: [1-[1-(3-fluoro-4-methyl-benzoyl)-4-piperidyl]triazol-4-yl]methylammonium Formula: C16H21FN5O+ MolecularWeight: 318.369243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)N3C=C(N=N3)C[NH3+])F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)N3C=C(N=N3)C[NH3+])F

InChI

InChI=1S/C16H20FN5O/c1-11-2-3-12(8-15(11)17)16(23)21-6-4-14(5-7-21)22-10-13(9-18)19-20-22/h2-3,8,10,14H,4-7,9,18H2,1H3/p+1