6-tert-butyl-8-oxidanyl-3-(phenylsulfonyl)chromen-2-one

Systemtic Name: 6-tert-butyl-8-oxidanyl-3-(phenylsulfonyl)chromen-2-one Openeye Name: 3-(benzenesulfonyl)-6-tert-butyl-8-hydroxy-chromen-2-one CAS Name: 3-(benzenesulfonyl)-6-tert-butyl-8-hydroxy-1-benzopyran-2-one IUPAC Name: 3-(benzenesulfonyl)-6-tert-butyl-8-hydroxychromen-2-one Traditional Name: 3-besyl-6-tert-butyl-8-hydroxy-coumarin Formula: C19H18O5S MolecularWeight: 358.40822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C1)C=C(C(=O)O2)S(=O)(=O)C3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C1)C=C(C(=O)O2)S(=O)(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C19H18O5S/c1-19(2,3)13-9-12-10-16(18(21)24-17(12)15(20)11-13)25(22,23)14-7-5-4-6-8-14/h4-11,20H,1-3H3