(2-oxidanylidenechromen-7-yl) 4-chloranyl-3-methyl-benzenesulfonate

Systemtic Name: (2-oxidanylidenechromen-7-yl) 4-chloranyl-3-methyl-benzenesulfonate Openeye Name: (2-oxochromen-7-yl) 4-chloro-3-methyl-benzenesulfonate CAS Name: 4-chloro-3-methylbenzenesulfonic acid (2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (2-oxochromen-7-yl) 4-chloro-3-methylbenzenesulfonate Traditional Name: 4-chloro-3-methyl-benzenesulfonic acid (2-ketochromen-7-yl) ester Formula: C16H11ClO5S MolecularWeight: 350.77354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)OC2=CC3=C(C=C2)C=CC(=O)O3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)OC2=CC3=C(C=C2)C=CC(=O)O3)Cl

InChI

InChI=1S/C16H11ClO5S/c1-10-8-13(5-6-14(10)17)23(19,20)22-12-4-2-11-3-7-16(18)21-15(11)9-12/h2-9H,1H3