(2S)-4-(carboxycarbonylamino)-2-(phenylmethoxycarbonylamino)butanoic acid

Systemtic Name: (2S)-4-(carboxycarbonylamino)-2-(phenylmethoxycarbonylamino)butanoic acid Openeye Name: (2S)-2-(benzyloxycarbonylamino)-4-(oxaloamino)butanoic acid CAS Name: (2S)-4-(oxaloamino)-2-(phenylmethoxycarbonylamino)butanoic acid IUPAC Name: (2S)-4-(oxaloamino)-2-(phenylmethoxycarbonylamino)butanoic acid Traditional Name: (2S)-2-(benzyloxycarbonylamino)-4-(oxaloamino)butyric acid Formula: C14H16N2O7 MolecularWeight: 324.28604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCNC(=O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N[C@@H](CCNC(=O)C(=O)O)C(=O)O

InChI

InChI=1S/C14H16N2O7/c17-11(13(20)21)15-7-6-10(12(18)19)16-14(22)23-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,15,17)(H,16,22)(H,18,19)(H,20,21)/t10-/m0/s1