methyl 3-[[2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]phenyl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]phenyl]carbonylamino]benzoate Openeye Name: methyl 3-[[2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]benzoyl]amino]benzoate CAS Name: 3-[[[2-[(5-methyl-3-nitro-1-pyrazolyl)methyl]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzoyl]amino]benzoate Traditional Name: 3-[[2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]benzoyl]amino]benzoic acid methyl ester Formula: C20H18N4O5 MolecularWeight: 394.38072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC=CC=C2C(=O)NC3=CC=CC(=C3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CC2=CC=CC=C2C(=O)NC3=CC=CC(=C3)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O5/c1-13-10-18(24(27)28)22-23(13)12-15-6-3-4-9-17(15)19(25)21-16-8-5-7-14(11-16)20(26)29-2/h3-11H,12H2,1-2H3,(H,21,25)