N,N-diethyl-4-[4-[2-(2-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[4-[2-(2-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[4-[2-(2-methyl-1-piperidyl)-2-oxo-ethyl]piperazin-1-yl]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[4-[2-(2-methyl-1-piperidinyl)-2-oxoethyl]-1-piperazinyl]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-[4-[2-keto-2-(2-methylpiperidino)ethyl]piperazino]-3-nitro-benzenesulfonamide Formula: C22H35N5O5S MolecularWeight: 481.6088

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC(=O)N3CCCCC3C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC(=O)N3CCCCC3C)[N+](=O)[O-]

InChI

InChI=1S/C22H35N5O5S/c1-4-25(5-2)33(31,32)19-9-10-20(21(16-19)27(29)30)24-14-12-23(13-15-24)17-22(28)26-11-7-6-8-18(26)3/h9-10,16,18H,4-8,11-15,17H2,1-3H3