4-(5-azanyl-4-ethoxycarbonyl-pyrazol-1-yl)benzoate

Systemtic Name: 4-(5-azanyl-4-ethoxycarbonyl-pyrazol-1-yl)benzoate Openeye Name: 4-(5-amino-4-ethoxycarbonyl-pyrazol-1-yl)benzoate CAS Name: 4-(5-amino-4-ethoxycarbonyl-1-pyrazolyl)benzoate IUPAC Name: 4-(5-amino-4-ethoxycarbonylpyrazol-1-yl)benzoate Traditional Name: 4-(5-amino-4-carbethoxy-pyrazol-1-yl)benzoate Formula: C13H12N3O4- MolecularWeight: 274.25208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)[O-])N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)[O-])N

InChI

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