N'-[2-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propylsulfanyl]ethanoyl]-3-nitro-benzohydrazide

Systemtic Name: N'-[2-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propylsulfanyl]ethanoyl]-3-nitro-benzohydrazide Openeye Name: N'-[2-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propylsulfanyl]acetyl]-3-nitro-benzohydrazide CAS Name: N'-[2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propylthio]-1-oxoethyl]-3-nitrobenzohydrazide IUPAC Name: N'-[2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propylsulfanyl]acetyl]-3-nitrobenzohydrazide Traditional Name: N'-[2-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propylthio]acetyl]-3-nitro-benzohydrazide Formula: C26H35N3O5S MolecularWeight: 501.6382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCSCC(=O)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCSCC(=O)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C26H35N3O5S/c1-25(2,3)20-13-17(14-21(23(20)31)26(4,5)6)9-8-12-35-16-22(30)27-28-24(32)18-10-7-11-19(15-18)29(33)34/h7,10-11,13-15,31H,8-9,12,16H2,1-6H3,(H,27,30)(H,28,32)