2-(4-acetyloxyphenyl)ethanoic acid; 3-(4-acetyloxyphenyl)propanoic acid

Systemtic Name: 2-(4-acetyloxyphenyl)ethanoic acid; 3-(4-acetyloxyphenyl)propanoic acid Openeye Name: 2-(4-acetoxyphenyl)acetic acid; 3-(4-acetoxyphenyl)propanoic acid CAS Name: 2-(4-acetyloxyphenyl)acetic acid; 3-(4-acetyloxyphenyl)propanoic acid IUPAC Name: 2-(4-acetyloxyphenyl)acetic acid; 3-(4-acetyloxyphenyl)propanoic acid Traditional Name: 2-(4-acetoxyphenyl)acetic acid; 3-(4-acetoxyphenyl)propionic acid Formula: C21H22O8 MolecularWeight: 402.39458

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)CCC(=O)O.CC(=O)OC1=CC=C(C=C1)CC(=O)O

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)CCC(=O)O.CC(=O)OC1=CC=C(C=C1)CC(=O)O

InChI

InChI=1S/C11H12O4.C10H10O4/c1-8(12)15-10-5-2-9(3-6-10)4-7-11(13)14;1-7(11)14-9-4-2-8(3-5-9)6-10(12)13/h2-3,5-6H,4,7H2,1H3,(H,13,14);2-5H,6H2,1H3,(H,12,13)