1-(2,5-dimethylthiophen-3-yl)-3,5,5-trimethyl-hexan-1-one

Systemtic Name: 1-(2,5-dimethylthiophen-3-yl)-3,5,5-trimethyl-hexan-1-one Openeye Name: 1-(2,5-dimethyl-3-thienyl)-3,5,5-trimethyl-hexan-1-one CAS Name: 1-(2,5-dimethyl-3-thiophenyl)-3,5,5-trimethyl-1-hexanone IUPAC Name: 1-(2,5-dimethylthiophen-3-yl)-3,5,5-trimethylhexan-1-one Traditional Name: 1-(2,5-dimethyl-3-thienyl)-3,5,5-trimethyl-hexan-1-one Formula: C15H24OS MolecularWeight: 252.41546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CC(C)CC(C)(C)C

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CC(C)CC(C)(C)C

InChI

InChI=1S/C15H24OS/c1-10(9-15(4,5)6)7-14(16)13-8-11(2)17-12(13)3/h8,10H,7,9H2,1-6H3