4-(5-azanyl-3-methyl-4-phenyl-pyrazol-1-yl)benzoate

Systemtic Name: 4-(5-azanyl-3-methyl-4-phenyl-pyrazol-1-yl)benzoate Openeye Name: 4-(5-amino-3-methyl-4-phenyl-pyrazol-1-yl)benzoate CAS Name: 4-(5-amino-3-methyl-4-phenyl-1-pyrazolyl)benzoate IUPAC Name: 4-(5-amino-3-methyl-4-phenylpyrazol-1-yl)benzoate Traditional Name: 4-(5-amino-3-methyl-4-phenyl-pyrazol-1-yl)benzoate Formula: C17H14N3O2- MolecularWeight: 292.31196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2=CC=CC=C2)N)C3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC1=NN(C(=C1C2=CC=CC=C2)N)C3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C17H15N3O2/c1-11-15(12-5-3-2-4-6-12)16(18)20(19-11)14-9-7-13(8-10-14)17(21)22/h2-10H,18H2,1H3,(H,21,22)/p-1