3-[[3-(cyanomethoxy)phenyl]methylamino]propanoic acid

Systemtic Name: 3-[[3-(cyanomethoxy)phenyl]methylamino]propanoic acid Openeye Name: 3-[[3-(cyanomethoxy)phenyl]methylamino]propanoic acid CAS Name: 3-[[3-(cyanomethoxy)phenyl]methylamino]propanoic acid IUPAC Name: 3-[[3-(cyanomethoxy)phenyl]methylamino]propanoic acid Traditional Name: 3-[[3-(cyanomethoxy)benzyl]amino]propionic acid Formula: C12H14N2O3 MolecularWeight: 234.25116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC#N)CNCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)OCC#N)CNCCC(=O)O

InChI

InChI=1S/C12H14N2O3/c13-5-7-17-11-3-1-2-10(8-11)9-14-6-4-12(15)16/h1-3,8,14H,4,6-7,9H2,(H,15,16)