2-[[4-(2-methylpropanoylamino)phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[4-(2-methylpropanoylamino)phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[4-(2-methylpropanoylamino)benzoyl]amino]acetic acid CAS Name: 2-[[[4-[(2-methyl-1-oxopropyl)amino]phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[4-(2-methylpropanoylamino)benzoyl]amino]acetic acid Traditional Name: 2-[[4-(isobutyrylamino)benzoyl]amino]acetic acid Formula: C13H16N2O4 MolecularWeight: 264.27714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O4/c1-8(2)12(18)15-10-5-3-9(4-6-10)13(19)14-7-11(16)17/h3-6,8H,7H2,1-2H3,(H,14,19)(H,15,18)(H,16,17)