3-[(Z)-3-ethoxy-3-oxidanylidene-2-phenylsulfanyl-prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylic acid

Systemtic Name: 3-[(Z)-3-ethoxy-3-oxidanylidene-2-phenylsulfanyl-prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylic acid Openeye Name: 3-[(Z)-3-ethoxy-3-oxo-2-phenylsulfanyl-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylic acid CAS Name: 3-[(Z)-3-ethoxy-3-oxo-2-(phenylthio)prop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid IUPAC Name: 3-[(Z)-3-ethoxy-3-oxo-2-phenylsulfanylprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylic acid Traditional Name: 3-[(Z)-3-ethoxy-3-keto-2-(phenylthio)prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylic acid Formula: C17H20O4S MolecularWeight: 320.4033

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1C(C1(C)C)C(=O)O)SC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C(=C/C1C(C1(C)C)C(=O)O)/SC2=CC=CC=C2

InChI

InChI=1S/C17H20O4S/c1-4-21-16(20)13(22-11-8-6-5-7-9-11)10-12-14(15(18)19)17(12,2)3/h5-10,12,14H,4H2,1-3H3,(H,18,19)/b13-10-