3-methyl-N'-[2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]ethanoyl]-1-benzofuran-2-carbohydrazide

Systemtic Name: 3-methyl-N'-[2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]ethanoyl]-1-benzofuran-2-carbohydrazide Openeye Name: 3-methyl-N'-[2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acetyl]benzofuran-2-carbohydrazide CAS Name: 3-methyl-N'-[2-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]-1-oxoethyl]-2-benzofurancarbohydrazide IUPAC Name: 3-methyl-N'-[2-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]acetyl]-1-benzofuran-2-carbohydrazide Traditional Name: 3-methyl-N'-[2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acetyl]coumarilohydrazide Formula: C27H21N5O5 MolecularWeight: 495.48614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NNC(=O)CC3=CN(N=C3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NNC(=O)CC3=CN(N=C3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C27H21N5O5/c1-17-22-9-5-6-10-23(22)37-26(17)27(34)29-28-24(33)15-19-16-31(20-7-3-2-4-8-20)30-25(19)18-11-13-21(14-12-18)32(35)36/h2-14,16H,15H2,1H3,(H,28,33)(H,29,34)