6-(4-decoxyphenyl)sulfonyl-2-(2,2-dimethylpropanoyl)-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-(4-decoxyphenyl)sulfonyl-2-(2,2-dimethylpropanoyl)-4H-1,4-benzoxazin-3-one Openeye Name: 6-(4-decoxyphenyl)sulfonyl-2-(2,2-dimethylpropanoyl)-4H-1,4-benzoxazin-3-one CAS Name: 6-(4-decoxyphenyl)sulfonyl-2-(2,2-dimethyl-1-oxopropyl)-4H-1,4-benzoxazin-3-one IUPAC Name: 6-(4-decoxyphenyl)sulfonyl-2-(2,2-dimethylpropanoyl)-4H-1,4-benzoxazin-3-one Traditional Name: 6-(4-decoxyphenyl)sulfonyl-2-pivaloyl-4H-1,4-benzoxazin-3-one Formula: C29H39NO6S MolecularWeight: 529.68806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)S(=O)(=O)C2=CC3=C(C=C2)OC(C(=O)N3)C(=O)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)S(=O)(=O)C2=CC3=C(C=C2)OC(C(=O)N3)C(=O)C(C)(C)C

InChI

InChI=1S/C29H39NO6S/c1-5-6-7-8-9-10-11-12-19-35-21-13-15-22(16-14-21)37(33,34)23-17-18-25-24(20-23)30-28(32)26(36-25)27(31)29(2,3)4/h13-18,20,26H,5-12,19H2,1-4H3,(H,30,32)