4-chloranyl-N-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]-3-nitro-N-phenyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]-3-nitro-N-phenyl-benzenesulfonamide Openeye Name: 4-chloro-N-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]-3-nitro-N-phenyl-benzenesulfonamide CAS Name: 4-chloro-N-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-3-nitro-N-phenylbenzenesulfonamide IUPAC Name: 4-chloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-nitro-N-phenylbenzenesulfonamide Traditional Name: 4-chloro-N-[2-keto-2-(4-methylpiperidino)ethyl]-3-nitro-N-phenyl-benzenesulfonamide Formula: C20H22ClN3O5S MolecularWeight: 451.92378

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C(=O)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H22ClN3O5S/c1-15-9-11-22(12-10-15)20(25)14-23(16-5-3-2-4-6-16)30(28,29)17-7-8-18(21)19(13-17)24(26)27/h2-8,13,15H,9-12,14H2,1H3