3-(3-nitrophenyl)-1-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-(3-nitrophenyl)-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 3-(3-nitrophenyl)-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 3-(3-nitrophenyl)-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 3-(3-nitrophenyl)-1-phenylpyrazole-4-carboxylic acid Traditional Name: 3-(3-nitrophenyl)-1-phenyl-pyrazole-4-carboxylic acid Formula: C16H11N3O4 MolecularWeight: 309.27624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C16H11N3O4/c20-16(21)14-10-18(12-6-2-1-3-7-12)17-15(14)11-5-4-8-13(9-11)19(22)23/h1-10H,(H,20,21)