2-[4-[(E)-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-prop-1-enyl]phenyl]sulfanylethanoic acid

Systemtic Name: 2-[4-[(E)-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-prop-1-enyl]phenyl]sulfanylethanoic acid Openeye Name: 2-[4-[(E)-3-tert-butoxy-3-oxo-prop-1-enyl]phenyl]sulfanylacetic acid CAS Name: 2-[[4-[(E)-3-[(2-methylpropan-2-yl)oxy]-3-oxoprop-1-enyl]phenyl]thio]acetic acid IUPAC Name: 2-[4-[(E)-3-[(2-methylpropan-2-yl)oxy]-3-oxoprop-1-enyl]phenyl]sulfanylacetic acid Traditional Name: 2-[[4-[(E)-3-tert-butoxy-3-keto-prop-1-enyl]phenyl]thio]acetic acid Formula: C15H18O4S MolecularWeight: 294.36602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)/C=C/C1=CC=C(C=C1)SCC(=O)O

InChI

InChI=1S/C15H18O4S/c1-15(2,3)19-14(18)9-6-11-4-7-12(8-5-11)20-10-13(16)17/h4-9H,10H2,1-3H3,(H,16,17)/b9-6+