4-[3-[4-(3,3-dimethyl-2-oxidanylidene-butoxy)-3-methyl-phenyl]pentan-3-yl]-2-methyl-N-(methylsulfonylmethyl)benzamide

Systemtic Name: 4-[3-[4-(3,3-dimethyl-2-oxidanylidene-butoxy)-3-methyl-phenyl]pentan-3-yl]-2-methyl-N-(methylsulfonylmethyl)benzamide Openeye Name: 4-[1-[4-(3,3-dimethyl-2-oxo-butoxy)-3-methyl-phenyl]-1-ethyl-propyl]-2-methyl-N-(methylsulfonylmethyl)benzamide CAS Name: 4-[3-[4-(3,3-dimethyl-2-oxobutoxy)-3-methylphenyl]pentan-3-yl]-2-methyl-N-(methylsulfonylmethyl)benzamide IUPAC Name: 4-[3-[4-(3,3-dimethyl-2-oxobutoxy)-3-methylphenyl]pentan-3-yl]-2-methyl-N-(methylsulfonylmethyl)benzamide Traditional Name: 4-[1-ethyl-1-[4-(2-keto-3,3-dimethyl-butoxy)-3-methyl-phenyl]propyl]-N-(mesylmethyl)-2-methyl-benzamide Formula: C28H39NO5S MolecularWeight: 501.67796

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC(=C(C=C1)C(=O)NCS(=O)(=O)C)C)C2=CC(=C(C=C2)OCC(=O)C(C)(C)C)C

Isomeric SMILES

CCC(CC)(C1=CC(=C(C=C1)C(=O)NCS(=O)(=O)C)C)C2=CC(=C(C=C2)OCC(=O)C(C)(C)C)C

InChI

InChI=1S/C28H39NO5S/c1-9-28(10-2,21-11-13-23(19(3)15-21)26(31)29-18-35(8,32)33)22-12-14-24(20(4)16-22)34-17-25(30)27(5,6)7/h11-16H,9-10,17-18H2,1-8H3,(H,29,31)