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

Systemtic Name: ethyl 2-[3,5-dimethyl-4-[(3-methyl-4-nitro-phenyl)carbonylamino]pyrazol-1-yl]ethanoate Openeye Name: ethyl 2-[3,5-dimethyl-4-[(3-methyl-4-nitro-benzoyl)amino]pyrazol-1-yl]acetate CAS Name: 2-[3,5-dimethyl-4-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]-1-pyrazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3,5-dimethyl-4-[(3-methyl-4-nitrobenzoyl)amino]pyrazol-1-yl]acetate Traditional Name: 2-[3,5-dimethyl-4-[(3-methyl-4-nitro-benzoyl)amino]pyrazol-1-yl]acetic acid ethyl ester Formula: C17H20N4O5 MolecularWeight: 360.3645

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4O5/c1-5-26-15(22)9-20-12(4)16(11(3)19-20)18-17(23)13-6-7-14(21(24)25)10(2)8-13/h6-8H,5,9H2,1-4H3,(H,18,23)