3-[[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]amino]propanoic acid

Systemtic Name: 3-[[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]amino]propanoic acid Openeye Name: 3-[[2-(benzylamino)-2-oxo-ethyl]amino]propanoic acid CAS Name: 3-[[2-oxo-2-[(phenylmethyl)amino]ethyl]amino]propanoic acid IUPAC Name: 3-[[2-(benzylamino)-2-oxoethyl]amino]propanoic acid Traditional Name: 3-[[2-(benzylamino)-2-keto-ethyl]amino]propionic acid Formula: C12H16N2O3 MolecularWeight: 236.26704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CNCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CNCCC(=O)O

InChI

InChI=1S/C12H16N2O3/c15-11(9-13-7-6-12(16)17)14-8-10-4-2-1-3-5-10/h1-5,13H,6-9H2,(H,14,15)(H,16,17)