[3-methyl-5-(4-oxidanylpiperidin-1-yl)-1-phenyl-pyrazol-4-yl]methylazanium

Systemtic Name: [3-methyl-5-(4-oxidanylpiperidin-1-yl)-1-phenyl-pyrazol-4-yl]methylazanium Openeye Name: [5-(4-hydroxy-1-piperidyl)-3-methyl-1-phenyl-pyrazol-4-yl]methylammonium CAS Name: [5-(4-hydroxy-1-piperidinyl)-3-methyl-1-phenyl-4-pyrazolyl]methylammonium IUPAC Name: [5-(4-hydroxypiperidin-1-yl)-3-methyl-1-phenylpyrazol-4-yl]methylazanium Traditional Name: [5-(4-hydroxypiperidino)-3-methyl-1-phenyl-pyrazol-4-yl]methylammonium Formula: C16H23N4O+ MolecularWeight: 287.38002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C[NH3+])N2CCC(CC2)O)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C[NH3+])N2CCC(CC2)O)C3=CC=CC=C3

InChI

InChI=1S/C16H22N4O/c1-12-15(11-17)16(19-9-7-14(21)8-10-19)20(18-12)13-5-3-2-4-6-13/h2-6,14,21H,7-11,17H2,1H3/p+1