methyl 2-[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]amino]acetate CAS Name: 2-[[[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[3-(3,4-dimethoxyphenyl)-1-phenylpyrazole-4-carbonyl]amino]acetate Traditional Name: 2-[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]amino]acetic acid methyl ester Formula: C21H21N3O5 MolecularWeight: 395.40854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C(=O)NCC(=O)OC)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2C(=O)NCC(=O)OC)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H21N3O5/c1-27-17-10-9-14(11-18(17)28-2)20-16(21(26)22-12-19(25)29-3)13-24(23-20)15-7-5-4-6-8-15/h4-11,13H,12H2,1-3H3,(H,22,26)