4-[3-(2,6-dimethylmorpholin-4-yl)propylamino]-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[3-(2,6-dimethylmorpholin-4-yl)propylamino]-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-[3-(2,6-dimethylmorpholin-4-yl)propylamino]-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-[3-(2,6-dimethyl-4-morpholinyl)propylamino]-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[3-(2,6-dimethylmorpholin-4-yl)propylamino]-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-[3-(2,6-dimethylmorpholino)propylamino]-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C19H32N4O5S MolecularWeight: 428.54618

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCCCN2CC(OC(C2)C)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCCCN2CC(OC(C2)C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H32N4O5S/c1-5-22(6-2)29(26,27)17-8-9-18(19(12-17)23(24)25)20-10-7-11-21-13-15(3)28-16(4)14-21/h8-9,12,15-16,20H,5-7,10-11,13-14H2,1-4H3