N-[2-[[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-4-nitro-N-propyl-benzamide

Systemtic Name: N-[2-[[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-4-nitro-N-propyl-benzamide Openeye Name: N-[2-[[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl]-4-nitro-N-propyl-benzamide CAS Name: N-[2-[[2-(2-chlorophenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]-4-nitro-N-propylbenzamide IUPAC Name: N-[2-[[2-(2-chlorophenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]-4-nitro-N-propylbenzamide Traditional Name: N-[2-[[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-keto-ethyl]-4-nitro-N-propyl-benzamide Formula: C27H24ClN5O4 MolecularWeight: 517.96356

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC(=NN1C2=CC=CC=C2Cl)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC(=O)NC1=CC(=NN1C2=CC=CC=C2Cl)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H24ClN5O4/c1-2-16-31(27(35)20-12-14-21(15-13-20)33(36)37)18-26(34)29-25-17-23(19-8-4-3-5-9-19)30-32(25)24-11-7-6-10-22(24)28/h3-15,17H,2,16,18H2,1H3,(H,29,34)