N-[3-(1-methylpiperidin-4-yl)carbonylphenyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-(1-methylpiperidin-4-yl)carbonylphenyl]-3-nitro-benzenesulfonamide Openeye Name: N-[3-(1-methylpiperidine-4-carbonyl)phenyl]-3-nitro-benzenesulfonamide CAS Name: N-[3-[(1-methyl-4-piperidinyl)-oxomethyl]phenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(1-methylpiperidine-4-carbonyl)phenyl]-3-nitrobenzenesulfonamide Traditional Name: N-[3-(1-methylisonipecotoyl)phenyl]-3-nitro-benzenesulfonamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CN1CCC(CC1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O5S/c1-21-10-8-14(9-11-21)19(23)15-4-2-5-16(12-15)20-28(26,27)18-7-3-6-17(13-18)22(24)25/h2-7,12-14,20H,8-11H2,1H3