dimethyl 5-[[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]amino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]amino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-methyl-3-(4-nitro-1-pyrazolyl)-1-oxopropyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C17H18N4O7 MolecularWeight: 390.34742

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H18N4O7/c1-10(8-20-9-14(7-18-20)21(25)26)15(22)19-13-5-11(16(23)27-2)4-12(6-13)17(24)28-3/h4-7,9-10H,8H2,1-3H3,(H,19,22)