3-(3,4-dimethoxyphenyl)sulfonyl-6-hexyl-7-oxidanyl-chromen-2-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)sulfonyl-6-hexyl-7-oxidanyl-chromen-2-one Openeye Name: 3-(3,4-dimethoxyphenyl)sulfonyl-6-hexyl-7-hydroxy-chromen-2-one CAS Name: 3-(3,4-dimethoxyphenyl)sulfonyl-6-hexyl-7-hydroxy-1-benzopyran-2-one IUPAC Name: 3-(3,4-dimethoxyphenyl)sulfonyl-6-hexyl-7-hydroxychromen-2-one Traditional Name: 3-(3,4-dimethoxyphenyl)sulfonyl-6-hexyl-7-hydroxy-coumarin Formula: C23H26O7S MolecularWeight: 446.51334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C=C(C(=O)O2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC)O

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C=C(C(=O)O2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC)O

InChI

InChI=1S/C23H26O7S/c1-4-5-6-7-8-15-11-16-12-22(23(25)30-20(16)14-18(15)24)31(26,27)17-9-10-19(28-2)21(13-17)29-3/h9-14,24H,4-8H2,1-3H3