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

Systemtic Name: methyl 4-[[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]amino]methyl]benzoate CAS Name: 4-[[[[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[3-(3,4-dimethoxyphenyl)-1-phenylpyrazole-4-carbonyl]amino]methyl]benzoate Traditional Name: 4-[[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]amino]methyl]benzoic acid methyl ester Formula: C27H25N3O5 MolecularWeight: 471.5045

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C(=O)NCC3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2C(=O)NCC3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4)OC

InChI

InChI=1S/C27H25N3O5/c1-33-23-14-13-20(15-24(23)34-2)25-22(17-30(29-25)21-7-5-4-6-8-21)26(31)28-16-18-9-11-19(12-10-18)27(32)35-3/h4-15,17H,16H2,1-3H3,(H,28,31)