ethyl (1S,2S)-2-[3-(3-methylsulfanylphenyl)propanoyl]cyclopropane-1-carboxylate

Systemtic Name: ethyl (1S,2S)-2-[3-(3-methylsulfanylphenyl)propanoyl]cyclopropane-1-carboxylate Openeye Name: ethyl (1S,2S)-2-[3-(3-methylsulfanylphenyl)propanoyl]cyclopropanecarboxylate CAS Name: (1S,2S)-2-[3-[3-(methylthio)phenyl]-1-oxopropyl]-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,2S)-2-[3-(3-methylsulfanylphenyl)propanoyl]cyclopropane-1-carboxylate Traditional Name: (1S,2S)-2-[3-[3-(methylthio)phenyl]propanoyl]cyclopropanecarboxylic acid ethyl ester Formula: C16H20O3S MolecularWeight: 292.3932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC1C(=O)CCC2=CC(=CC=C2)SC

Isomeric SMILES

CCOC(=O)[C@H]1C[C@@H]1C(=O)CCC2=CC(=CC=C2)SC

InChI

InChI=1S/C16H20O3S/c1-3-19-16(18)14-10-13(14)15(17)8-7-11-5-4-6-12(9-11)20-2/h4-6,9,13-14H,3,7-8,10H2,1-2H3/t13-,14-/m0/s1