ethyl 2-[3,5-dimethyl-4-[2-(3-methyl-4-nitro-phenoxy)ethanoylamino]pyrazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[3,5-dimethyl-4-[2-(3-methyl-4-nitro-phenoxy)ethanoylamino]pyrazol-1-yl]ethanoate Openeye Name: ethyl 2-[3,5-dimethyl-4-[[2-(3-methyl-4-nitro-phenoxy)acetyl]amino]pyrazol-1-yl]acetate CAS Name: 2-[3,5-dimethyl-4-[[2-(3-methyl-4-nitrophenoxy)-1-oxoethyl]amino]-1-pyrazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3,5-dimethyl-4-[[2-(3-methyl-4-nitrophenoxy)acetyl]amino]pyrazol-1-yl]acetate Traditional Name: 2-[3,5-dimethyl-4-[[2-(3-methyl-4-nitro-phenoxy)acetyl]amino]pyrazol-1-yl]acetic acid ethyl ester Formula: C18H22N4O6 MolecularWeight: 390.39048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=C(C(=N1)C)NC(=O)COC2=CC(=C(C=C2)[N+](=O)[O-])C)C

Isomeric SMILES

CCOC(=O)CN1C(=C(C(=N1)C)NC(=O)COC2=CC(=C(C=C2)[N+](=O)[O-])C)C

InChI

InChI=1S/C18H22N4O6/c1-5-27-17(24)9-21-13(4)18(12(3)20-21)19-16(23)10-28-14-6-7-15(22(25)26)11(2)8-14/h6-8H,5,9-10H2,1-4H3,(H,19,23)