methyl 3-(3-methyl-1-phenyl-butyl)sulfanylpropanoate

Systemtic Name: methyl 3-(3-methyl-1-phenyl-butyl)sulfanylpropanoate Openeye Name: methyl 3-(3-methyl-1-phenyl-butyl)sulfanylpropanoate CAS Name: 3-[(3-methyl-1-phenylbutyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-(3-methyl-1-phenylbutyl)sulfanylpropanoate Traditional Name: 3-[(3-methyl-1-phenyl-butyl)thio]propionic acid methyl ester Formula: C15H22O2S MolecularWeight: 266.39898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)SCCC(=O)OC

Isomeric SMILES

CC(C)CC(C1=CC=CC=C1)SCCC(=O)OC

InChI

InChI=1S/C15H22O2S/c1-12(2)11-14(13-7-5-4-6-8-13)18-10-9-15(16)17-3/h4-8,12,14H,9-11H2,1-3H3