4-methyl-1,3-dioxetan-2-one; 2-phenylethanoic acid

Systemtic Name: 4-methyl-1,3-dioxetan-2-one; 2-phenylethanoic acid Openeye Name: 4-methyl-1,3-dioxetan-2-one; 2-phenylacetic acid CAS Name: 4-methyl-1,3-dioxetan-2-one; 2-phenylacetic acid IUPAC Name: 4-methyl-1,3-dioxetan-2-one; 2-phenylacetic acid Traditional Name: 4-methyl-1,3-dioxetan-2-one; 2-phenylacetic acid Formula: C11H12O5 MolecularWeight: 224.20998

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Descriptors Computed from Structure

Canonical SMILES:

CC1OC(=O)O1.C1=CC=C(C=C1)CC(=O)O

Isomeric SMILES

CC1OC(=O)O1.C1=CC=C(C=C1)CC(=O)O

InChI

InChI=1S/C8H8O2.C3H4O3/c9-8(10)6-7-4-2-1-3-5-7;1-2-5-3(4)6-2/h1-5H,6H2,(H,9,10);2H,1H3