N'-[4-(3,5-dimethylpiperidin-1-yl)-3-nitro-phenyl]carbonyl-1,3-benzodioxole-5-carbohydrazide

Systemtic Name: N'-[4-(3,5-dimethylpiperidin-1-yl)-3-nitro-phenyl]carbonyl-1,3-benzodioxole-5-carbohydrazide Openeye Name: N'-[4-(3,5-dimethyl-1-piperidyl)-3-nitro-benzoyl]-1,3-benzodioxole-5-carbohydrazide CAS Name: N'-[[4-(3,5-dimethyl-1-piperidinyl)-3-nitrophenyl]-oxomethyl]-1,3-benzodioxole-5-carbohydrazide IUPAC Name: N'-[4-(3,5-dimethylpiperidin-1-yl)-3-nitrobenzoyl]-1,3-benzodioxole-5-carbohydrazide Traditional Name: N'-[4-(3,5-dimethylpiperidino)-3-nitro-benzoyl]-1,3-benzodioxole-5-carbohydrazide Formula: C22H24N4O6 MolecularWeight: 440.44916

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=C(C=C(C=C2)C(=O)NNC(=O)C3=CC4=C(C=C3)OCO4)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)C2=C(C=C(C=C2)C(=O)NNC(=O)C3=CC4=C(C=C3)OCO4)[N+](=O)[O-])C

InChI

InChI=1S/C22H24N4O6/c1-13-7-14(2)11-25(10-13)17-5-3-15(8-18(17)26(29)30)21(27)23-24-22(28)16-4-6-19-20(9-16)32-12-31-19/h3-6,8-9,13-14H,7,10-12H2,1-2H3,(H,23,27)(H,24,28)