(4-methyl-2-oxidanylidene-3-propyl-chromen-7-yl) 4-chloranylbenzenesulfonate

Systemtic Name: (4-methyl-2-oxidanylidene-3-propyl-chromen-7-yl) 4-chloranylbenzenesulfonate Openeye Name: (4-methyl-2-oxo-3-propyl-chromen-7-yl) 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid (4-methyl-2-oxo-3-propyl-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxo-3-propylchromen-7-yl) 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid (2-keto-4-methyl-3-propyl-chromen-7-yl) ester Formula: C19H17ClO5S MolecularWeight: 392.85328

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(C=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)Cl)OC1=O)C

Isomeric SMILES

CCCC1=C(C2=C(C=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)Cl)OC1=O)C

InChI

InChI=1S/C19H17ClO5S/c1-3-4-17-12(2)16-10-7-14(11-18(16)24-19(17)21)25-26(22,23)15-8-5-13(20)6-9-15/h5-11H,3-4H2,1-2H3