N-(5-chloranyl-2-methoxy-phenyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-(5-chloro-2-methoxyphenyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-4-methyl-3-nitro-benzenesulfonamide Formula: C25H24ClN3O6S MolecularWeight: 529.99256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)N2CCC3=CC=CC=C3C2)C4=C(C=CC(=C4)Cl)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)N2CCC3=CC=CC=C3C2)C4=C(C=CC(=C4)Cl)OC)[N+](=O)[O-]

InChI

InChI=1S/C25H24ClN3O6S/c1-17-7-9-21(14-22(17)29(31)32)36(33,34)28(23-13-20(26)8-10-24(23)35-2)16-25(30)27-12-11-18-5-3-4-6-19(18)15-27/h3-10,13-14H,11-12,15-16H2,1-2H3