methyl 4-methyl-3-[[5-[(4-nitropyrazol-1-yl)methyl]furan-2-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[[5-[(4-nitropyrazol-1-yl)methyl]furan-2-yl]carbonylamino]benzoate Openeye Name: methyl 4-methyl-3-[[5-[(4-nitropyrazol-1-yl)methyl]furan-2-carbonyl]amino]benzoate CAS Name: 4-methyl-3-[[[5-[(4-nitro-1-pyrazolyl)methyl]-2-furanyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[5-[(4-nitropyrazol-1-yl)methyl]furan-2-carbonyl]amino]benzoate Traditional Name: 4-methyl-3-[[5-[(4-nitropyrazol-1-yl)methyl]-2-furoyl]amino]benzoic acid methyl ester Formula: C18H16N4O6 MolecularWeight: 384.34284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC=C(O2)CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC=C(O2)CN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O6/c1-11-3-4-12(18(24)27-2)7-15(11)20-17(23)16-6-5-14(28-16)10-21-9-13(8-19-21)22(25)26/h3-9H,10H2,1-2H3,(H,20,23)