4-[(5-methyl-3-nitro-pyrazol-1-yl)methoxy]benzoic acid

Systemtic Name: 4-[(5-methyl-3-nitro-pyrazol-1-yl)methoxy]benzoic acid Openeye Name: 4-[(5-methyl-3-nitro-pyrazol-1-yl)methoxy]benzoic acid CAS Name: 4-[(5-methyl-3-nitro-1-pyrazolyl)methoxy]benzoic acid IUPAC Name: 4-[(5-methyl-3-nitropyrazol-1-yl)methoxy]benzoic acid Traditional Name: 4-[(5-methyl-3-nitro-pyrazol-1-yl)methoxy]benzoic acid Formula: C12H11N3O5 MolecularWeight: 277.23284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1COC2=CC=C(C=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1COC2=CC=C(C=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O5/c1-8-6-11(15(18)19)13-14(8)7-20-10-4-2-9(3-5-10)12(16)17/h2-6H,7H2,1H3,(H,16,17)