4-methyl-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-methyl-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-3-nitro-benzenesulfonamide Openeye Name: 4-methyl-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-3-nitro-benzenesulfonamide CAS Name: 4-methyl-N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-methyl-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-3-nitrobenzenesulfonamide Traditional Name: 4-methyl-N-(4-methyl-3-piperidinosulfonyl-phenyl)-3-nitro-benzenesulfonamide Formula: C19H23N3O6S2 MolecularWeight: 453.53242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O6S2/c1-14-7-9-17(13-18(14)22(23)24)29(25,26)20-16-8-6-15(2)19(12-16)30(27,28)21-10-4-3-5-11-21/h6-9,12-13,20H,3-5,10-11H2,1-2H3