(1-azanyl-1-oxidanylidene-propan-2-yl) 3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 3-(3-methoxyphenyl)-1-phenyl-4-pyrazolecarboxylic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 3-(3-methoxyphenyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxylic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=CN(N=C1C2=CC(=CC=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N)OC(=O)C1=CN(N=C1C2=CC(=CC=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C20H19N3O4/c1-13(19(21)24)27-20(25)17-12-23(15-8-4-3-5-9-15)22-18(17)14-7-6-10-16(11-14)26-2/h3-13H,1-2H3,(H2,21,24)