N-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-1-(3-nitrophenyl)methanesulfonamide

Systemtic Name: N-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-1-(3-nitrophenyl)methanesulfonamide Openeye Name: N-(4-methoxy-3-morpholinosulfonyl-phenyl)-1-(3-nitrophenyl)methanesulfonamide CAS Name: N-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-1-(3-nitrophenyl)methanesulfonamide IUPAC Name: N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-1-(3-nitrophenyl)methanesulfonamide Traditional Name: N-(4-methoxy-3-morpholinosulfonyl-phenyl)-1-(3-nitrophenyl)methanesulfonamide Formula: C18H21N3O8S2 MolecularWeight: 471.50464

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NS(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)NS(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H21N3O8S2/c1-28-17-6-5-15(12-18(17)31(26,27)20-7-9-29-10-8-20)19-30(24,25)13-14-3-2-4-16(11-14)21(22)23/h2-6,11-12,19H,7-10,13H2,1H3