4-(3,5-dimethylpiperidin-1-yl)-N'-(3-methylsulfonylphenyl)carbonyl-3-nitro-benzohydrazide

Systemtic Name: 4-(3,5-dimethylpiperidin-1-yl)-N'-(3-methylsulfonylphenyl)carbonyl-3-nitro-benzohydrazide Openeye Name: 4-(3,5-dimethyl-1-piperidyl)-N'-(3-methylsulfonylbenzoyl)-3-nitro-benzohydrazide CAS Name: 4-(3,5-dimethyl-1-piperidinyl)-N'-[(3-methylsulfonylphenyl)-oxomethyl]-3-nitrobenzohydrazide IUPAC Name: 4-(3,5-dimethylpiperidin-1-yl)-N'-(3-methylsulfonylbenzoyl)-3-nitrobenzohydrazide Traditional Name: 4-(3,5-dimethylpiperidino)-N'-(3-mesylbenzoyl)-3-nitro-benzohydrazide Formula: C22H26N4O6S MolecularWeight: 474.53004

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=C(C=C(C=C2)C(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)C)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)C2=C(C=C(C=C2)C(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)C)[N+](=O)[O-])C

InChI

InChI=1S/C22H26N4O6S/c1-14-9-15(2)13-25(12-14)19-8-7-17(11-20(19)26(29)30)22(28)24-23-21(27)16-5-4-6-18(10-16)33(3,31)32/h4-8,10-11,14-15H,9,12-13H2,1-3H3,(H,23,27)(H,24,28)