N-(2-dimethylaminoethyl)-4-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-yl]-3-nitro-benzenesulfonamide Openeye Name: N-(2-dimethylaminoethyl)-4-[4-(2-morpholino-2-oxo-ethyl)piperazin-1-yl]-3-nitro-benzenesulfonamide CAS Name: N-(2-dimethylaminoethyl)-4-[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazinyl]-3-nitrobenzenesulfonamide IUPAC Name: N-(2-dimethylaminoethyl)-4-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]-3-nitrobenzenesulfonamide Traditional Name: N-(2-dimethylaminoethyl)-4-[4-(2-keto-2-morpholino-ethyl)piperazino]-3-nitro-benzenesulfonamide Formula: C20H32N6O6S MolecularWeight: 484.56968

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCNS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H32N6O6S/c1-22(2)6-5-21-33(30,31)17-3-4-18(19(15-17)26(28)29)24-9-7-23(8-10-24)16-20(27)25-11-13-32-14-12-25/h3-4,15,21H,5-14,16H2,1-2H3