(5-chloranyl-7-methoxy-4-methyl-1H-indol-3-yl) (4-chloranyl-1-sulfooxy-naphthalen-2-yl) sulfate

Systemtic Name: (5-chloranyl-7-methoxy-4-methyl-1H-indol-3-yl) (4-chloranyl-1-sulfooxy-naphthalen-2-yl) sulfate Openeye Name: (5-chloro-7-methoxy-4-methyl-1H-indol-3-yl) (4-chloro-1-sulfooxy-2-naphthyl) sulfate CAS Name: sulfuric acid (5-chloro-7-methoxy-4-methyl-1H-indol-3-yl) (4-chloro-1-sulfooxy-2-naphthalenyl) ester IUPAC Name: (5-chloro-7-methoxy-4-methyl-1H-indol-3-yl) (4-chloro-1-sulfooxynaphthalen-2-yl) sulfate Traditional Name: sulfuric acid (5-chloro-7-methoxy-4-methyl-1H-indol-3-yl) (4-chloro-1-sulfoxy-2-naphthyl) ester Formula: C20H15Cl2NO9S2 MolecularWeight: 548.3704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C2=C1C(=CN2)OS(=O)(=O)OC3=C(C4=CC=CC=C4C(=C3)Cl)OS(=O)(=O)O)OC)Cl

Isomeric SMILES

CC1=C(C=C(C2=C1C(=CN2)OS(=O)(=O)OC3=C(C4=CC=CC=C4C(=C3)Cl)OS(=O)(=O)O)OC)Cl

InChI

InChI=1S/C20H15Cl2NO9S2/c1-10-13(21)7-15(29-2)19-18(10)17(9-23-19)31-34(27,28)30-16-8-14(22)11-5-3-4-6-12(11)20(16)32-33(24,25)26/h3-9,23H,1-2H3,(H,24,25,26)