2-ethanoyl-2-[(3-fluorophenyl)methyl]butanedioic acid

Systemtic Name: 2-ethanoyl-2-[(3-fluorophenyl)methyl]butanedioic acid Openeye Name: 2-acetyl-2-[(3-fluorophenyl)methyl]butanedioic acid CAS Name: 2-acetyl-2-[(3-fluorophenyl)methyl]butanedioic acid IUPAC Name: 2-acetyl-2-[(3-fluorophenyl)methyl]butanedioic acid Traditional Name: 2-acetyl-2-(3-fluorobenzyl)succinic acid Formula: C13H13FO5 MolecularWeight: 268.237723

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC(=CC=C1)F)(CC(=O)O)C(=O)O

Isomeric SMILES

CC(=O)C(CC1=CC(=CC=C1)F)(CC(=O)O)C(=O)O

InChI

InChI=1S/C13H13FO5/c1-8(15)13(12(18)19,7-11(16)17)6-9-3-2-4-10(14)5-9/h2-5H,6-7H2,1H3,(H,16,17)(H,18,19)