3-[3,5-dimethyl-4-[(3-nitrophenyl)diazenyl]pyrazol-1-yl]benzoate

Systemtic Name: 3-[3,5-dimethyl-4-[(3-nitrophenyl)diazenyl]pyrazol-1-yl]benzoate Openeye Name: 3-[3,5-dimethyl-4-(3-nitrophenyl)azo-pyrazol-1-yl]benzoate CAS Name: 3-[3,5-dimethyl-4-(3-nitrophenyl)azo-1-pyrazolyl]benzoate IUPAC Name: 3-[3,5-dimethyl-4-[(3-nitrophenyl)diazenyl]pyrazol-1-yl]benzoate Traditional Name: 3-[3,5-dimethyl-4-(3-nitrophenyl)azo-pyrazol-1-yl]benzoate Formula: C18H14N5O4- MolecularWeight: 364.33486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC(=C2)C(=O)[O-])C)N=NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC(=C2)C(=O)[O-])C)N=NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N5O4/c1-11-17(20-19-14-6-4-8-16(10-14)23(26)27)12(2)22(21-11)15-7-3-5-13(9-15)18(24)25/h3-10H,1-2H3,(H,24,25)/p-1