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

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl 2-[(3,4-dimethoxyphenyl)carbonylamino]ethanoate Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl 2-[(3,4-dimethoxybenzoyl)amino]acetate CAS Name: 2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]acetic acid (1,3-diphenyl-4-pyrazolyl)methyl ester IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl 2-[(3,4-dimethoxybenzoyl)amino]acetate Traditional Name: 2-(veratroylamino)acetic acid (1,3-diphenylpyrazol-4-yl)methyl ester Formula: C27H25N3O5 MolecularWeight: 471.5045

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC(=O)OCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC(=O)OCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C27H25N3O5/c1-33-23-14-13-20(15-24(23)34-2)27(32)28-16-25(31)35-18-21-17-30(22-11-7-4-8-12-22)29-26(21)19-9-5-3-6-10-19/h3-15,17H,16,18H2,1-2H3,(H,28,32)