2-[(1-oxidanylidene-1-phenylmethoxy-but-3-en-2-yl)amino]ethanoic acid

Systemtic Name: 2-[(1-oxidanylidene-1-phenylmethoxy-but-3-en-2-yl)amino]ethanoic acid Openeye Name: 2-(1-benzyloxycarbonylallylamino)acetic acid CAS Name: 2-[(1-oxo-1-phenylmethoxybut-3-en-2-yl)amino]acetic acid IUPAC Name: 2-[(1-oxo-1-phenylmethoxybut-3-en-2-yl)amino]acetic acid Traditional Name: 2-(1-carbobenzoxyallylamino)acetic acid Formula: C13H15NO4 MolecularWeight: 249.2625

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC(C(=O)OCC1=CC=CC=C1)NCC(=O)O

Isomeric SMILES

C=CC(C(=O)OCC1=CC=CC=C1)NCC(=O)O

InChI

InChI=1S/C13H15NO4/c1-2-11(14-8-12(15)16)13(17)18-9-10-6-4-3-5-7-10/h2-7,11,14H,1,8-9H2,(H,15,16)