N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]-4-nitro-benzenesulfonamide Openeye Name: N-[4-[(2-methyl-1-piperidyl)sulfonyl]phenyl]-4-nitro-benzenesulfonamide CAS Name: N-[4-[(2-methyl-1-piperidinyl)sulfonyl]phenyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]-4-nitrobenzenesulfonamide Traditional Name: N-[4-(2-methylpiperidino)sulfonylphenyl]-4-nitro-benzenesulfonamide Formula: C18H21N3O6S2 MolecularWeight: 439.50584

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O6S2/c1-14-4-2-3-13-20(14)29(26,27)18-9-5-15(6-10-18)19-28(24,25)17-11-7-16(8-12-17)21(22)23/h5-12,14,19H,2-4,13H2,1H3