N-[4-[[2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]ethanoylamino]methyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[[2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]ethanoylamino]methyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[4-[[[2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acetyl]amino]methyl]phenyl]cyclopropanecarboxamide CAS Name: N-[4-[[[2-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]-1-oxoethyl]amino]methyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[[[2-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]acetyl]amino]methyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[4-[[[2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acetyl]amino]methyl]phenyl]cyclopropanecarboxamide Formula: C28H25N5O4 MolecularWeight: 495.5292

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=C(C=C2)CNC(=O)CC3=CN(N=C3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

C1CC1C(=O)NC2=CC=C(C=C2)CNC(=O)CC3=CN(N=C3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C28H25N5O4/c34-26(29-17-19-6-12-23(13-7-19)30-28(35)21-8-9-21)16-22-18-32(24-4-2-1-3-5-24)31-27(22)20-10-14-25(15-11-20)33(36)37/h1-7,10-15,18,21H,8-9,16-17H2,(H,29,34)(H,30,35)