4-chloranyl-N1-[(3R)-3-(dimethylamino)-5-methoxy-3,4-dihydro-2H-chromen-8-yl]benzene-1,3-disulfonamide

Systemtic Name: 4-chloranyl-N1-[(3R)-3-(dimethylamino)-5-methoxy-3,4-dihydro-2H-chromen-8-yl]benzene-1,3-disulfonamide Openeye Name: 4-chloro-N1-[(3R)-3-(dimethylamino)-5-methoxy-chroman-8-yl]benzene-1,3-disulfonamide CAS Name: 4-chloro-N1-[(3R)-3-(dimethylamino)-5-methoxy-3,4-dihydro-2H-1-benzopyran-8-yl]benzene-1,3-disulfonamide IUPAC Name: 4-chloro-1-N-[(3R)-3-(dimethylamino)-5-methoxy-3,4-dihydro-2H-chromen-8-yl]benzene-1,3-disulfonamide Traditional Name: 4-chloro-N-[(3R)-3-(dimethylamino)-5-methoxy-chroman-8-yl]benzene-1,3-disulfonamide Formula: C18H22ClN3O6S2 MolecularWeight: 475.96678

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CC2=C(C=CC(=C2OC1)NS(=O)(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N)OC

Isomeric SMILES

CN(C)[C@@H]1CC2=C(C=CC(=C2OC1)NS(=O)(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N)OC

InChI

InChI=1S/C18H22ClN3O6S2/c1-22(2)11-8-13-16(27-3)7-6-15(18(13)28-10-11)21-30(25,26)12-4-5-14(19)17(9-12)29(20,23)24/h4-7,9,11,21H,8,10H2,1-3H3,(H2,20,23,24)/t11-/m1/s1