4-ethoxycarbonyl-3-phenylazanyl-1H-pyrazole-5-carboxylic acid

Systemtic Name: 4-ethoxycarbonyl-3-phenylazanyl-1H-pyrazole-5-carboxylic acid Openeye Name: 3-anilino-4-ethoxycarbonyl-1H-pyrazole-5-carboxylic acid CAS Name: 3-anilino-4-ethoxycarbonyl-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-anilino-4-ethoxycarbonyl-1H-pyrazole-5-carboxylic acid Traditional Name: 3-anilino-4-carbethoxy-1H-pyrazole-5-carboxylic acid Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1NC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCOC(=O)C1=C(NN=C1NC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C13H13N3O4/c1-2-20-13(19)9-10(12(17)18)15-16-11(9)14-8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H,17,18)(H2,14,15,16)