3-oxidanylpropanamide; 2-(phenylmethoxycarbonylamino)ethanoic acid

Systemtic Name: 3-oxidanylpropanamide; 2-(phenylmethoxycarbonylamino)ethanoic acid Openeye Name: 2-(benzyloxycarbonylamino)acetic acid; 3-hydroxypropanamide CAS Name: 3-hydroxypropanamide; 2-(phenylmethoxycarbonylamino)acetic acid IUPAC Name: 3-hydroxypropanamide; 2-(phenylmethoxycarbonylamino)acetic acid Traditional Name: 2-(benzyloxycarbonylamino)acetic acid; 3-hydroxypropionamide Formula: C13H18N2O6 MolecularWeight: 298.29182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCC(=O)O.C(CO)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCC(=O)O.C(CO)C(=O)N

InChI

InChI=1S/C10H11NO4.C3H7NO2/c12-9(13)6-11-10(14)15-7-8-4-2-1-3-5-8;4-3(6)1-2-5/h1-5H,6-7H2,(H,11,14)(H,12,13);5H,1-2H2,(H2,4,6)