ethane; 2-oxidanylidene-4-phenyl-butanoic acid

Systemtic Name: ethane; 2-oxidanylidene-4-phenyl-butanoic acid Openeye Name: ethane; 2-oxo-4-phenyl-butanoic acid CAS Name: ethane; 2-oxo-4-phenylbutanoic acid IUPAC Name: ethane; 2-oxo-4-phenylbutanoic acid Traditional Name: ethane; 2-keto-4-phenyl-butyric acid Formula: C12H16O3 MolecularWeight: 208.25364

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Descriptors Computed from Structure

Canonical SMILES:

CC.C1=CC=C(C=C1)CCC(=O)C(=O)O

Isomeric SMILES

CC.C1=CC=C(C=C1)CCC(=O)C(=O)O

InChI

InChI=1S/C10H10O3.C2H6/c11-9(10(12)13)7-6-8-4-2-1-3-5-8;1-2/h1-5H,6-7H2,(H,12,13);1-2H3