2-[[4-(prop-2-ynoylamino)phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[4-(prop-2-ynoylamino)phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[4-(prop-2-ynoylamino)benzoyl]amino]acetic acid CAS Name: 2-[[oxo-[4-(1-oxoprop-2-ynylamino)phenyl]methyl]amino]acetic acid IUPAC Name: 2-[[4-(prop-2-ynoylamino)benzoyl]amino]acetic acid Traditional Name: 2-[[4-(propioloylamino)benzoyl]amino]acetic acid Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10N2O4/c1-2-10(15)14-9-5-3-8(4-6-9)12(18)13-7-11(16)17/h1,3-6H,7H2,(H,13,18)(H,14,15)(H,16,17)