3-(1H-imidazol-2-yl)-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 3-(1H-imidazol-2-yl)-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-3-(1H-imidazol-2-yl)propanoic acid CAS Name: 3-(1H-imidazol-2-yl)-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 3-(1H-imidazol-2-yl)-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-3-(1H-imidazol-2-yl)propionic acid Formula: C14H15N3O4 MolecularWeight: 289.2866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC2=NC=CN2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC2=NC=CN2)C(=O)O

InChI

InChI=1S/C14H15N3O4/c18-13(19)11(8-12-15-6-7-16-12)17-14(20)21-9-10-4-2-1-3-5-10/h1-7,11H,8-9H2,(H,15,16)(H,17,20)(H,18,19)