(4,5-dimethyl-2-oxidanylidene-chromen-7-yl) 4-methylbenzenesulfonate

Systemtic Name: (4,5-dimethyl-2-oxidanylidene-chromen-7-yl) 4-methylbenzenesulfonate Openeye Name: (4,5-dimethyl-2-oxo-chromen-7-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (4,5-dimethyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4,5-dimethyl-2-oxochromen-7-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-keto-4,5-dimethyl-chromen-7-yl) ester Formula: C18H16O5S MolecularWeight: 344.38164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16O5S/c1-11-4-6-15(7-5-11)24(20,21)23-14-8-12(2)18-13(3)9-17(19)22-16(18)10-14/h4-10H,1-3H3