N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-yl-ethyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-yl-ethyl]-2-nitro-benzenesulfonamide Openeye Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholino-ethyl]-2-nitro-benzenesulfonamide CAS Name: N-[(2R)-2-(4-methoxyphenyl)-2-(4-morpholinyl)ethyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2-nitrobenzenesulfonamide Traditional Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholino-ethyl]-2-nitro-benzenesulfonamide Formula: C19H23N3O6S MolecularWeight: 421.46742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C19H23N3O6S/c1-27-16-8-6-15(7-9-16)18(21-10-12-28-13-11-21)14-20-29(25,26)19-5-3-2-4-17(19)22(23)24/h2-9,18,20H,10-14H2,1H3/t18-/m0/s1