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

Systemtic Name: 5-[[4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]phenyl]carbonylamino]-1-benzofuran-2-carboxamide Openeye Name: 5-[[4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzoyl]amino]benzofuran-2-carboxamide CAS Name: 5-[[[4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]phenyl]-oxomethyl]amino]-2-benzofurancarboxamide IUPAC Name: 5-[[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzoyl]amino]-1-benzofuran-2-carboxamide Traditional Name: 5-[[4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzoyl]amino]coumarilamide Formula: C22H19N5O5 MolecularWeight: 433.41676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)OC(=C4)C(=O)N)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)OC(=C4)C(=O)N)C)[N+](=O)[O-]

InChI

InChI=1S/C22H19N5O5/c1-12-20(27(30)31)13(2)26(25-12)11-14-3-5-15(6-4-14)22(29)24-17-7-8-18-16(9-17)10-19(32-18)21(23)28/h3-10H,11H2,1-2H3,(H2,23,28)(H,24,29)