(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl]azanium

Systemtic Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl]azanium Openeye Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]ammonium CAS Name: (3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl-methyl-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]ammonium IUPAC Name: (3,5-dimethyl-1-phenylpyrazol-4-yl)methyl-methyl-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]azanium Traditional Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-[(4-keto-1,2,3-benzotriazin-3-yl)methyl]-methyl-ammonium Formula: C21H23N6O+ MolecularWeight: 375.44692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C[NH+](C)CN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C[NH+](C)CN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C21H22N6O/c1-15-19(16(2)27(23-15)17-9-5-4-6-10-17)13-25(3)14-26-21(28)18-11-7-8-12-20(18)22-24-26/h4-12H,13-14H2,1-3H3/p+1