2-[[2-cyanoethyl(phenyl)carbamoyl]-methyl-amino]ethanoic acid

Systemtic Name: 2-[[2-cyanoethyl(phenyl)carbamoyl]-methyl-amino]ethanoic acid Openeye Name: 2-[[2-cyanoethyl(phenyl)carbamoyl]-methyl-amino]acetic acid CAS Name: 2-[[[N-(2-cyanoethyl)anilino]-oxomethyl]-methylamino]acetic acid IUPAC Name: 2-[[2-cyanoethyl(phenyl)carbamoyl]-methylamino]acetic acid Traditional Name: 2-[[2-cyanoethyl(phenyl)carbamoyl]-methyl-amino]acetic acid Formula: C13H15N3O3 MolecularWeight: 261.2765

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)N(CCC#N)C1=CC=CC=C1

Isomeric SMILES

CN(CC(=O)O)C(=O)N(CCC#N)C1=CC=CC=C1

InChI

InChI=1S/C13H15N3O3/c1-15(10-12(17)18)13(19)16(9-5-8-14)11-6-3-2-4-7-11/h2-4,6-7H,5,9-10H2,1H3,(H,17,18)