2-[(phenylmethyl)amino]propanedioic acid; pyrrolidine

Systemtic Name: 2-[(phenylmethyl)amino]propanedioic acid; pyrrolidine Openeye Name: 2-(benzylamino)propanedioic acid; pyrrolidine CAS Name: 2-[(phenylmethyl)amino]propanedioic acid; pyrrolidine IUPAC Name: 2-(benzylamino)propanedioic acid; pyrrolidine Traditional Name: 2-(benzylamino)malonic acid; pyrrolidine Formula: C14H20N2O4 MolecularWeight: 280.3196

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC1.C1=CC=C(C=C1)CNC(C(=O)O)C(=O)O

Isomeric SMILES

C1CCNC1.C1=CC=C(C=C1)CNC(C(=O)O)C(=O)O

InChI

InChI=1S/C10H11NO4.C4H9N/c12-9(13)8(10(14)15)11-6-7-4-2-1-3-5-7;1-2-4-5-3-1/h1-5,8,11H,6H2,(H,12,13)(H,14,15);5H,1-4H2