3-methyl-5-(2-nitrophenyl)-1-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-methyl-5-(2-nitrophenyl)-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 3-methyl-5-(2-nitrophenyl)-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 3-methyl-5-(2-nitrophenyl)-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 3-methyl-5-(2-nitrophenyl)-1-phenylpyrazole-4-carboxylic acid Traditional Name: 3-methyl-5-(2-nitrophenyl)-1-phenyl-pyrazole-4-carboxylic acid Formula: C17H13N3O4 MolecularWeight: 323.30282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)O)C2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)O)C2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C17H13N3O4/c1-11-15(17(21)22)16(13-9-5-6-10-14(13)20(23)24)19(18-11)12-7-3-2-4-8-12/h2-10H,1H3,(H,21,22)