4-methoxy-5-methyl-5-(phenylmethyl)thiophen-2-one

Systemtic Name: 4-methoxy-5-methyl-5-(phenylmethyl)thiophen-2-one Openeye Name: 5-benzyl-4-methoxy-5-methyl-thiophen-2-one CAS Name: 4-methoxy-5-methyl-5-(phenylmethyl)-2-thiophenone IUPAC Name: 5-benzyl-4-methoxy-5-methylthiophen-2-one Traditional Name: 5-benzyl-4-methoxy-5-methyl-thiophen-2-one Formula: C13H14O2S MolecularWeight: 234.31406

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=CC(=O)S1)OC)CC2=CC=CC=C2

Isomeric SMILES

CC1(C(=CC(=O)S1)OC)CC2=CC=CC=C2

InChI

InChI=1S/C13H14O2S/c1-13(9-10-6-4-3-5-7-10)11(15-2)8-12(14)16-13/h3-8H,9H2,1-2H3