(7-chloranyl-3,5,8-trimethoxy-naphthalen-1-yl) 4-methylbenzenesulfonate

Systemtic Name: (7-chloranyl-3,5,8-trimethoxy-naphthalen-1-yl) 4-methylbenzenesulfonate Openeye Name: (7-chloro-3,5,8-trimethoxy-1-naphthyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (7-chloro-3,5,8-trimethoxy-1-naphthalenyl) ester IUPAC Name: (7-chloro-3,5,8-trimethoxynaphthalen-1-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (7-chloro-3,5,8-trimethoxy-1-naphthyl) ester Formula: C20H19ClO6S MolecularWeight: 422.87926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C3C(=CC(=C2)OC)C(=CC(=C3OC)Cl)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C3C(=CC(=C2)OC)C(=CC(=C3OC)Cl)OC

InChI

InChI=1S/C20H19ClO6S/c1-12-5-7-14(8-6-12)28(22,23)27-18-10-13(24-2)9-15-17(25-3)11-16(21)20(26-4)19(15)18/h5-11H,1-4H3