3-(4-tert-butylphenyl)sulfonyl-8-ethoxy-chromen-2-one

Systemtic Name: 3-(4-tert-butylphenyl)sulfonyl-8-ethoxy-chromen-2-one Openeye Name: 3-(4-tert-butylphenyl)sulfonyl-8-ethoxy-chromen-2-one CAS Name: 3-(4-tert-butylphenyl)sulfonyl-8-ethoxy-1-benzopyran-2-one IUPAC Name: 3-(4-tert-butylphenyl)sulfonyl-8-ethoxychromen-2-one Traditional Name: 3-(4-tert-butylphenyl)sulfonyl-8-ethoxy-coumarin Formula: C21H22O5S MolecularWeight: 386.46138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1OC(=O)C(=C2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCOC1=CC=CC2=C1OC(=O)C(=C2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H22O5S/c1-5-25-17-8-6-7-14-13-18(20(22)26-19(14)17)27(23,24)16-11-9-15(10-12-16)21(2,3)4/h6-13H,5H2,1-4H3