4-[(1-ethylpyrazol-4-yl)amino]-3-nitro-benzoic acid

Systemtic Name: 4-[(1-ethylpyrazol-4-yl)amino]-3-nitro-benzoic acid Openeye Name: 4-[(1-ethylpyrazol-4-yl)amino]-3-nitro-benzoic acid CAS Name: 4-[(1-ethyl-4-pyrazolyl)amino]-3-nitrobenzoic acid IUPAC Name: 4-[(1-ethylpyrazol-4-yl)amino]-3-nitrobenzoic acid Traditional Name: 4-[(1-ethylpyrazol-4-yl)amino]-3-nitro-benzoic acid Formula: C12H12N4O4 MolecularWeight: 276.24808

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)NC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C=N1)NC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O4/c1-2-15-7-9(6-13-15)14-10-4-3-8(12(17)18)5-11(10)16(19)20/h3-7,14H,2H2,1H3,(H,17,18)