[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl] 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanoate

Systemtic Name: [2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl] 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanoate Openeye Name: [2-(ethoxycarbonylamino)-2-oxo-ethyl] 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanoate CAS Name: 3-[1-(3-methoxyphenyl)-3,5-dimethyl-4-pyrazolyl]propanoic acid [2-(ethoxycarbonylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethoxycarbonylamino)-2-oxoethyl] 3-[1-(3-methoxyphenyl)-3,5-dimethylpyrazol-4-yl]propanoate Traditional Name: 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propionic acid [2-(carbethoxyamino)-2-keto-ethyl] ester Formula: C20H25N3O6 MolecularWeight: 403.429

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)COC(=O)CCC1=C(N(N=C1C)C2=CC(=CC=C2)OC)C

Isomeric SMILES

CCOC(=O)NC(=O)COC(=O)CCC1=C(N(N=C1C)C2=CC(=CC=C2)OC)C

InChI

InChI=1S/C20H25N3O6/c1-5-28-20(26)21-18(24)12-29-19(25)10-9-17-13(2)22-23(14(17)3)15-7-6-8-16(11-15)27-4/h6-8,11H,5,9-10,12H2,1-4H3,(H,21,24,26)