(Z)-2-(tert-butylsulfanylmethyl)-3-phenyl-prop-2-enoic acid

Systemtic Name: (Z)-2-(tert-butylsulfanylmethyl)-3-phenyl-prop-2-enoic acid Openeye Name: (Z)-2-(tert-butylsulfanylmethyl)-3-phenyl-prop-2-enoic acid CAS Name: (Z)-2-[(tert-butylthio)methyl]-3-phenyl-2-propenoic acid IUPAC Name: (Z)-2-(tert-butylsulfanylmethyl)-3-phenylprop-2-enoic acid Traditional Name: (Z)-2-[(tert-butylthio)methyl]-3-phenyl-acrylic acid Formula: C14H18O2S MolecularWeight: 250.35652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC(=CC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(C)(C)SC/C(=C\C1=CC=CC=C1)/C(=O)O

InChI

InChI=1S/C14H18O2S/c1-14(2,3)17-10-12(13(15)16)9-11-7-5-4-6-8-11/h4-9H,10H2,1-3H3,(H,15,16)/b12-9+