4-[5-azanyl-4-(3,4-dimethoxyphenyl)pyrazol-1-yl]benzoate

Systemtic Name: 4-[5-azanyl-4-(3,4-dimethoxyphenyl)pyrazol-1-yl]benzoate Openeye Name: 4-[5-amino-4-(3,4-dimethoxyphenyl)pyrazol-1-yl]benzoate CAS Name: 4-[5-amino-4-(3,4-dimethoxyphenyl)-1-pyrazolyl]benzoate IUPAC Name: 4-[5-amino-4-(3,4-dimethoxyphenyl)pyrazol-1-yl]benzoate Traditional Name: 4-[5-amino-4-(3,4-dimethoxyphenyl)pyrazol-1-yl]benzoate Formula: C18H16N3O4- MolecularWeight: 338.33734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(N(N=C2)C3=CC=C(C=C3)C(=O)[O-])N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(N(N=C2)C3=CC=C(C=C3)C(=O)[O-])N)OC

InChI

InChI=1S/C18H17N3O4/c1-24-15-8-5-12(9-16(15)25-2)14-10-20-21(17(14)19)13-6-3-11(4-7-13)18(22)23/h3-10H,19H2,1-2H3,(H,22,23)/p-1