2-[3-(2-methylpropanoylamino)phenyl]ethanoic acid

Systemtic Name: 2-[3-(2-methylpropanoylamino)phenyl]ethanoic acid Openeye Name: 2-[3-(2-methylpropanoylamino)phenyl]acetic acid CAS Name: 2-[3-[(2-methyl-1-oxopropyl)amino]phenyl]acetic acid IUPAC Name: 2-[3-(2-methylpropanoylamino)phenyl]acetic acid Traditional Name: 2-[3-(isobutyrylamino)phenyl]acetic acid Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)CC(=O)O

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)CC(=O)O

InChI

InChI=1S/C12H15NO3/c1-8(2)12(16)13-10-5-3-4-9(6-10)7-11(14)15/h3-6,8H,7H2,1-2H3,(H,13,16)(H,14,15)