N-[2-(2,6-dimethylmorpholin-4-yl)carbonylphenyl]-3-nitro-4-oxidanyl-benzenesulfonamide

Systemtic Name: N-[2-(2,6-dimethylmorpholin-4-yl)carbonylphenyl]-3-nitro-4-oxidanyl-benzenesulfonamide Openeye Name: N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-4-hydroxy-3-nitro-benzenesulfonamide CAS Name: N-[2-[(2,6-dimethyl-4-morpholinyl)-oxomethyl]phenyl]-4-hydroxy-3-nitrobenzenesulfonamide IUPAC Name: N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-4-hydroxy-3-nitrobenzenesulfonamide Traditional Name: N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-4-hydroxy-3-nitro-benzenesulfonamide Formula: C19H21N3O7S MolecularWeight: 435.45094

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)C(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O7S/c1-12-10-21(11-13(2)29-12)19(24)15-5-3-4-6-16(15)20-30(27,28)14-7-8-18(23)17(9-14)22(25)26/h3-9,12-13,20,23H,10-11H2,1-2H3