N-(5-bromanyl-2-piperidin-1-ylcarbonyl-phenyl)-2-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-(5-bromanyl-2-piperidin-1-ylcarbonyl-phenyl)-2-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[5-bromo-2-(piperidine-1-carbonyl)phenyl]-2-methyl-3-nitro-benzenesulfonamide CAS Name: N-[5-bromo-2-[oxo(1-piperidinyl)methyl]phenyl]-2-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[5-bromo-2-(piperidine-1-carbonyl)phenyl]-2-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[5-bromo-2-(piperidine-1-carbonyl)phenyl]-2-methyl-3-nitro-benzenesulfonamide Formula: C19H20BrN3O5S MolecularWeight: 482.3482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1S(=O)(=O)NC2=C(C=CC(=C2)Br)C(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1S(=O)(=O)NC2=C(C=CC(=C2)Br)C(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H20BrN3O5S/c1-13-17(23(25)26)6-5-7-18(13)29(27,28)21-16-12-14(20)8-9-15(16)19(24)22-10-3-2-4-11-22/h5-9,12,21H,2-4,10-11H2,1H3