methyl (1R,3R)-2,2-dimethyl-3-phenylsulfanyl-1-prop-2-enyl-cyclopropane-1-carboxylate

Systemtic Name: methyl (1R,3R)-2,2-dimethyl-3-phenylsulfanyl-1-prop-2-enyl-cyclopropane-1-carboxylate Openeye Name: methyl (1R,3R)-1-allyl-2,2-dimethyl-3-phenylsulfanyl-cyclopropanecarboxylate CAS Name: (1R,3R)-2,2-dimethyl-3-(phenylthio)-1-prop-2-enyl-1-cyclopropanecarboxylic acid methyl ester IUPAC Name: methyl (1R,3R)-2,2-dimethyl-3-phenylsulfanyl-1-prop-2-enylcyclopropane-1-carboxylate Traditional Name: (1R,3R)-1-allyl-2,2-dimethyl-3-(phenylthio)cyclopropanecarboxylic acid methyl ester Formula: C16H20O2S MolecularWeight: 276.3938

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C1(CC=C)C(=O)OC)SC2=CC=CC=C2)C

Isomeric SMILES

CC1([C@H]([C@@]1(CC=C)C(=O)OC)SC2=CC=CC=C2)C

InChI

InChI=1S/C16H20O2S/c1-5-11-16(14(17)18-4)13(15(16,2)3)19-12-9-7-6-8-10-12/h5-10,13H,1,11H2,2-4H3/t13-,16+/m1/s1