3-ethoxy-2-[(2-methylphenyl)methyl]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-ethoxy-2-[(2-methylphenyl)methyl]-3-oxidanylidene-propanoic acid Openeye Name: 3-ethoxy-2-(o-tolylmethyl)-3-oxo-propanoic acid CAS Name: 3-ethoxy-2-[(2-methylphenyl)methyl]-3-oxopropanoic acid IUPAC Name: 3-ethoxy-2-[(2-methylphenyl)methyl]-3-oxopropanoic acid Traditional Name: 3-ethoxy-3-keto-2-(2-methylbenzyl)propionic acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1C)C(=O)O

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1C)C(=O)O

InChI

InChI=1S/C13H16O4/c1-3-17-13(16)11(12(14)15)8-10-7-5-4-6-9(10)2/h4-7,11H,3,8H2,1-2H3,(H,14,15)