4-(4-methylpiperidin-1-yl)-N'-(4-methylsulfonylphenyl)carbonyl-3-nitro-benzohydrazide

Systemtic Name: 4-(4-methylpiperidin-1-yl)-N'-(4-methylsulfonylphenyl)carbonyl-3-nitro-benzohydrazide Openeye Name: 4-(4-methyl-1-piperidyl)-N'-(4-methylsulfonylbenzoyl)-3-nitro-benzohydrazide CAS Name: 4-(4-methyl-1-piperidinyl)-N'-[(4-methylsulfonylphenyl)-oxomethyl]-3-nitrobenzohydrazide IUPAC Name: 4-(4-methylpiperidin-1-yl)-N'-(4-methylsulfonylbenzoyl)-3-nitrobenzohydrazide Traditional Name: N'-(4-mesylbenzoyl)-4-(4-methylpiperidino)-3-nitro-benzohydrazide Formula: C21H24N4O6S MolecularWeight: 460.50346

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NNC(=O)C3=CC=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NNC(=O)C3=CC=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O6S/c1-14-9-11-24(12-10-14)18-8-5-16(13-19(18)25(28)29)21(27)23-22-20(26)15-3-6-17(7-4-15)32(2,30)31/h3-8,13-14H,9-12H2,1-2H3,(H,22,26)(H,23,27)