(NE)-4-methyl-3-nitro-N-(1-piperidin-1-ylpropylidene)benzenesulfonamide

Systemtic Name: (NE)-4-methyl-3-nitro-N-(1-piperidin-1-ylpropylidene)benzenesulfonamide Openeye Name: (NE)-4-methyl-3-nitro-N-[1-(1-piperidyl)propylidene]benzenesulfonamide CAS Name: (NE)-4-methyl-3-nitro-N-[1-(1-piperidinyl)propylidene]benzenesulfonamide IUPAC Name: (NE)-4-methyl-3-nitro-N-(1-piperidin-1-ylpropylidene)benzenesulfonamide Traditional Name: (NE)-4-methyl-3-nitro-N-(1-piperidinopropylidene)benzenesulfonamide Formula: C15H21N3O4S MolecularWeight: 339.40994

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NS(=O)(=O)C1=CC(=C(C=C1)C)[N+](=O)[O-])N2CCCCC2

Isomeric SMILES

CC/C(=N\S(=O)(=O)C1=CC(=C(C=C1)C)[N+](=O)[O-])/N2CCCCC2

InChI

InChI=1S/C15H21N3O4S/c1-3-15(17-9-5-4-6-10-17)16-23(21,22)13-8-7-12(2)14(11-13)18(19)20/h7-8,11H,3-6,9-10H2,1-2H3/b16-15+