(2-oxidanylidene-4-propyl-chromen-7-yl) benzenesulfonate

Systemtic Name: (2-oxidanylidene-4-propyl-chromen-7-yl) benzenesulfonate Openeye Name: (2-oxo-4-propyl-chromen-7-yl) benzenesulfonate CAS Name: benzenesulfonic acid (2-oxo-4-propyl-1-benzopyran-7-yl) ester IUPAC Name: (2-oxo-4-propylchromen-7-yl) benzenesulfonate Traditional Name: benzenesulfonic acid (2-keto-4-propyl-chromen-7-yl) ester Formula: C18H16O5S MolecularWeight: 344.38164

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H16O5S/c1-2-6-13-11-18(19)22-17-12-14(9-10-16(13)17)23-24(20,21)15-7-4-3-5-8-15/h3-5,7-12H,2,6H2,1H3