1-[2-(2,2-dimethylpropanoyl)-5-methoxy-1-benzothiophen-3-yl]-3,3-dimethyl-butan-2-one

Systemtic Name: 1-[2-(2,2-dimethylpropanoyl)-5-methoxy-1-benzothiophen-3-yl]-3,3-dimethyl-butan-2-one Openeye Name: 1-[2-(2,2-dimethylpropanoyl)-5-methoxy-benzothiophen-3-yl]-3,3-dimethyl-butan-2-one CAS Name: 1-[2-(2,2-dimethyl-1-oxopropyl)-5-methoxy-1-benzothiophen-3-yl]-3,3-dimethyl-2-butanone IUPAC Name: 1-[2-(2,2-dimethylpropanoyl)-5-methoxy-1-benzothiophen-3-yl]-3,3-dimethylbutan-2-one Traditional Name: 1-(5-methoxy-2-pivaloyl-benzothiophen-3-yl)-3,3-dimethyl-butan-2-one Formula: C20H26O3S MolecularWeight: 346.48364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CC1=C(SC2=C1C=C(C=C2)OC)C(=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C(=O)CC1=C(SC2=C1C=C(C=C2)OC)C(=O)C(C)(C)C

InChI

InChI=1S/C20H26O3S/c1-19(2,3)16(21)11-14-13-10-12(23-7)8-9-15(13)24-17(14)18(22)20(4,5)6/h8-10H,11H2,1-7H3