4-[5-azanyl-4-(2-methoxyphenyl)-3-methyl-pyrazol-1-yl]benzoate

Systemtic Name: 4-[5-azanyl-4-(2-methoxyphenyl)-3-methyl-pyrazol-1-yl]benzoate Openeye Name: 4-[5-amino-4-(2-methoxyphenyl)-3-methyl-pyrazol-1-yl]benzoate CAS Name: 4-[5-amino-4-(2-methoxyphenyl)-3-methyl-1-pyrazolyl]benzoate IUPAC Name: 4-[5-amino-4-(2-methoxyphenyl)-3-methylpyrazol-1-yl]benzoate Traditional Name: 4-[5-amino-4-(2-methoxyphenyl)-3-methyl-pyrazol-1-yl]benzoate Formula: C18H16N3O3- MolecularWeight: 322.33794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2=CC=CC=C2OC)N)C3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC1=NN(C(=C1C2=CC=CC=C2OC)N)C3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C18H17N3O3/c1-11-16(14-5-3-4-6-15(14)24-2)17(19)21(20-11)13-9-7-12(8-10-13)18(22)23/h3-10H,19H2,1-2H3,(H,22,23)/p-1