N-(2,5-diethoxy-4-morpholin-4-yl-phenyl)-4-methoxy-3-nitro-benzenesulfonamide

Systemtic Name: N-(2,5-diethoxy-4-morpholin-4-yl-phenyl)-4-methoxy-3-nitro-benzenesulfonamide Openeye Name: N-(2,5-diethoxy-4-morpholino-phenyl)-4-methoxy-3-nitro-benzenesulfonamide CAS Name: N-[2,5-diethoxy-4-(4-morpholinyl)phenyl]-4-methoxy-3-nitrobenzenesulfonamide IUPAC Name: N-(2,5-diethoxy-4-morpholin-4-ylphenyl)-4-methoxy-3-nitrobenzenesulfonamide Traditional Name: N-(2,5-diethoxy-4-morpholino-phenyl)-4-methoxy-3-nitro-benzenesulfonamide Formula: C21H27N3O8S MolecularWeight: 481.51938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1N2CCOCC2)OCC)NS(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1N2CCOCC2)OCC)NS(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H27N3O8S/c1-4-31-20-14-17(23-8-10-30-11-9-23)21(32-5-2)13-16(20)22-33(27,28)15-6-7-19(29-3)18(12-15)24(25)26/h6-7,12-14,22H,4-5,8-11H2,1-3H3