2-azanyl-2,5-dimethyl-4-[(4-methylphenyl)diazenyl]-1-phenyl-pyrazol-2-ium-3-one

Systemtic Name: 2-azanyl-2,5-dimethyl-4-[(4-methylphenyl)diazenyl]-1-phenyl-pyrazol-2-ium-3-one Openeye Name: 2-amino-2,5-dimethyl-1-phenyl-4-(p-tolylazo)pyrazol-2-ium-3-one CAS Name: 2-amino-2,5-dimethyl-4-(4-methylphenyl)azo-1-phenyl-3-pyrazol-2-iumone IUPAC Name: 2-amino-2,5-dimethyl-4-[(4-methylphenyl)diazenyl]-1-phenylpyrazol-2-ium-3-one Traditional Name: 2-amino-2,5-dimethyl-1-phenyl-4-(p-tolylazo)-3-pyrazolin-2-ium-3-one Formula: C18H20N5O+ MolecularWeight: 322.3843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=NC2=C(N([N+](C2=O)(C)N)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)N=NC2=C(N([N+](C2=O)(C)N)C3=CC=CC=C3)C

InChI

InChI=1S/C18H20N5O/c1-13-9-11-15(12-10-13)20-21-17-14(2)22(23(3,19)18(17)24)16-7-5-4-6-8-16/h4-12H,19H2,1-3H3/q+1