(2-oxidanylidenechromen-7-yl) 3-methyl-4-propan-2-yloxy-benzenesulfonate

Systemtic Name: (2-oxidanylidenechromen-7-yl) 3-methyl-4-propan-2-yloxy-benzenesulfonate Openeye Name: (2-oxochromen-7-yl) 4-isopropoxy-3-methyl-benzenesulfonate CAS Name: 3-methyl-4-propan-2-yloxybenzenesulfonic acid (2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (2-oxochromen-7-yl) 3-methyl-4-propan-2-yloxybenzenesulfonate Traditional Name: 4-isopropoxy-3-methyl-benzenesulfonic acid (2-ketochromen-7-yl) ester Formula: C19H18O6S MolecularWeight: 374.40762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18O6S/c1-12(2)23-17-8-7-16(10-13(17)3)26(21,22)25-15-6-4-14-5-9-19(20)24-18(14)11-15/h4-12H,1-3H3