3-[4-(4-methylphenyl)butan-2-yloxy]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[4-(4-methylphenyl)butan-2-yloxy]-3-oxidanylidene-propanoic acid Openeye Name: 3-[1-methyl-3-(p-tolyl)propoxy]-3-oxo-propanoic acid CAS Name: 3-[4-(4-methylphenyl)butan-2-yloxy]-3-oxopropanoic acid IUPAC Name: 3-[4-(4-methylphenyl)butan-2-yloxy]-3-oxopropanoic acid Traditional Name: 3-keto-3-[1-methyl-3-(p-tolyl)propoxy]propionic acid Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18O4/c1-10-3-6-12(7-4-10)8-5-11(2)18-14(17)9-13(15)16/h3-4,6-7,11H,5,8-9H2,1-2H3,(H,15,16)