1-thiophen-2-yl-4-(2,3,6-trimethylphenoxy)butan-1-one

Systemtic Name: 1-thiophen-2-yl-4-(2,3,6-trimethylphenoxy)butan-1-one Openeye Name: 1-(2-thienyl)-4-(2,3,6-trimethylphenoxy)butan-1-one CAS Name: 1-thiophen-2-yl-4-(2,3,6-trimethylphenoxy)-1-butanone IUPAC Name: 1-thiophen-2-yl-4-(2,3,6-trimethylphenoxy)butan-1-one Traditional Name: 1-(2-thienyl)-4-(2,3,6-trimethylphenoxy)butan-1-one Formula: C17H20O2S MolecularWeight: 288.4045

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCCCC(=O)C2=CC=CS2)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCCCC(=O)C2=CC=CS2)C

InChI

InChI=1S/C17H20O2S/c1-12-8-9-13(2)17(14(12)3)19-10-4-6-15(18)16-7-5-11-20-16/h5,7-9,11H,4,6,10H2,1-3H3