(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 2-[(3,4-diethoxyphenyl)carbonylamino]ethanoate

Systemtic Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 2-[(3,4-diethoxyphenyl)carbonylamino]ethanoate Openeye Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 2-[(3,4-diethoxybenzoyl)amino]acetate CAS Name: 2-[[(3,4-diethoxyphenyl)-oxomethyl]amino]acetic acid (4-cyano-5-methyl-2-phenyl-3-pyrazolyl)methyl ester IUPAC Name: (4-cyano-5-methyl-2-phenylpyrazol-3-yl)methyl 2-[(3,4-diethoxybenzoyl)amino]acetate Traditional Name: 2-[(3,4-diethoxybenzoyl)amino]acetic acid (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl ester Formula: C25H26N4O5 MolecularWeight: 462.49774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCC(=O)OCC2=C(C(=NN2C3=CC=CC=C3)C)C#N)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCC(=O)OCC2=C(C(=NN2C3=CC=CC=C3)C)C#N)OCC

InChI

InChI=1S/C25H26N4O5/c1-4-32-22-12-11-18(13-23(22)33-5-2)25(31)27-15-24(30)34-16-21-20(14-26)17(3)28-29(21)19-9-7-6-8-10-19/h6-13H,4-5,15-16H2,1-3H3,(H,27,31)