2-[(3-ethynylphenyl)carbamoyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(3-ethynylphenyl)carbamoyl-methyl-amino]ethanoic acid Openeye Name: 2-[(3-ethynylphenyl)carbamoyl-methyl-amino]acetic acid CAS Name: 2-[[(3-ethynylanilino)-oxomethyl]-methylamino]acetic acid IUPAC Name: 2-[(3-ethynylphenyl)carbamoyl-methylamino]acetic acid Traditional Name: 2-[(3-ethynylphenyl)carbamoyl-methyl-amino]acetic acid Formula: C12H12N2O3 MolecularWeight: 232.23528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O3/c1-3-9-5-4-6-10(7-9)13-12(17)14(2)8-11(15)16/h1,4-7H,8H2,2H3,(H,13,17)(H,15,16)