N-[1-(3,5-dimethylphenyl)carbonylcyclohexyl]-4H-1,3-benzodioxine-6-sulfonamide

Systemtic Name: N-[1-(3,5-dimethylphenyl)carbonylcyclohexyl]-4H-1,3-benzodioxine-6-sulfonamide Openeye Name: N-[1-(3,5-dimethylbenzoyl)cyclohexyl]-4H-1,3-benzodioxine-6-sulfonamide CAS Name: N-[1-[(3,5-dimethylphenyl)-oxomethyl]cyclohexyl]-4H-1,3-benzodioxin-6-sulfonamide IUPAC Name: N-[1-(3,5-dimethylbenzoyl)cyclohexyl]-4H-1,3-benzodioxine-6-sulfonamide Traditional Name: N-[1-(3,5-dimethylbenzoyl)cyclohexyl]-4H-1,3-benzodioxin-6-sulfonamide Formula: C23H27NO5S MolecularWeight: 429.52918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)C2(CCCCC2)NS(=O)(=O)C3=CC4=C(C=C3)OCOC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)C2(CCCCC2)NS(=O)(=O)C3=CC4=C(C=C3)OCOC4)C

InChI

InChI=1S/C23H27NO5S/c1-16-10-17(2)12-18(11-16)22(25)23(8-4-3-5-9-23)24-30(26,27)20-6-7-21-19(13-20)14-28-15-29-21/h6-7,10-13,24H,3-5,8-9,14-15H2,1-2H3