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

Systemtic Name: [3-methyl-5-(3-oxidanylidenepiperazin-1-yl)-1-phenyl-pyrazol-4-yl]methylazanium Openeye Name: [3-methyl-5-(3-oxopiperazin-1-yl)-1-phenyl-pyrazol-4-yl]methylammonium CAS Name: [3-methyl-5-(3-oxo-1-piperazinyl)-1-phenyl-4-pyrazolyl]methylammonium IUPAC Name: [3-methyl-5-(3-oxopiperazin-1-yl)-1-phenylpyrazol-4-yl]methylazanium Traditional Name: [5-(3-ketopiperazino)-3-methyl-1-phenyl-pyrazol-4-yl]methylammonium Formula: C15H20N5O+ MolecularWeight: 286.3522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C[NH3+])N2CCNC(=O)C2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C[NH3+])N2CCNC(=O)C2)C3=CC=CC=C3

InChI

InChI=1S/C15H19N5O/c1-11-13(9-16)15(19-8-7-17-14(21)10-19)20(18-11)12-5-3-2-4-6-12/h2-6H,7-10,16H2,1H3,(H,17,21)/p+1