3-[2-(4-tert-butylphenyl)sulfonylethanoyl]-8-methyl-chromen-2-one

Systemtic Name: 3-[2-(4-tert-butylphenyl)sulfonylethanoyl]-8-methyl-chromen-2-one Openeye Name: 3-[2-(4-tert-butylphenyl)sulfonylacetyl]-8-methyl-chromen-2-one CAS Name: 3-[2-(4-tert-butylphenyl)sulfonyl-1-oxoethyl]-8-methyl-1-benzopyran-2-one IUPAC Name: 3-[2-(4-tert-butylphenyl)sulfonylacetyl]-8-methylchromen-2-one Traditional Name: 3-[2-(4-tert-butylphenyl)sulfonylacetyl]-8-methyl-coumarin Formula: C22H22O5S MolecularWeight: 398.47208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OC(=O)C(=C2)C(=O)CS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=CC2=C1OC(=O)C(=C2)C(=O)CS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H22O5S/c1-14-6-5-7-15-12-18(21(24)27-20(14)15)19(23)13-28(25,26)17-10-8-16(9-11-17)22(2,3)4/h5-12H,13H2,1-4H3