4-[(1-ethylpyrazol-4-yl)carbamoyl]benzoic acid

Systemtic Name: 4-[(1-ethylpyrazol-4-yl)carbamoyl]benzoic acid Openeye Name: 4-[(1-ethylpyrazol-4-yl)carbamoyl]benzoic acid CAS Name: 4-[[(1-ethyl-4-pyrazolyl)amino]-oxomethyl]benzoic acid IUPAC Name: 4-[(1-ethylpyrazol-4-yl)carbamoyl]benzoic acid Traditional Name: 4-[(1-ethylpyrazol-4-yl)carbamoyl]benzoic acid Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)NC(=O)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCN1C=C(C=N1)NC(=O)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H13N3O3/c1-2-16-8-11(7-14-16)15-12(17)9-3-5-10(6-4-9)13(18)19/h3-8H,2H2,1H3,(H,15,17)(H,18,19)