N-[(3R)-3-(dimethylamino)-5-methoxy-3,4-dihydro-2H-chromen-8-yl]-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[(3R)-3-(dimethylamino)-5-methoxy-3,4-dihydro-2H-chromen-8-yl]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[(3R)-3-(dimethylamino)-5-methoxy-chroman-8-yl]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-[(3R)-3-(dimethylamino)-5-methoxy-3,4-dihydro-2H-1-benzopyran-8-yl]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[(3R)-3-(dimethylamino)-5-methoxy-3,4-dihydro-2H-chromen-8-yl]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[(3R)-3-(dimethylamino)-5-methoxy-chroman-8-yl]-4-methyl-3-nitro-benzenesulfonamide Formula: C19H23N3O6S MolecularWeight: 421.46742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=C3C(=C(C=C2)OC)CC(CO3)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=C3C(=C(C=C2)OC)C[C@H](CO3)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O6S/c1-12-5-6-14(10-17(12)22(23)24)29(25,26)20-16-7-8-18(27-4)15-9-13(21(2)3)11-28-19(15)16/h5-8,10,13,20H,9,11H2,1-4H3/t13-/m1/s1