4-azanyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butanoic acid

Systemtic Name: 4-azanyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butanoic acid Openeye Name: 4-amino-2-(benzyloxycarbonylamino)-4-oxo-butanoic acid CAS Name: 4-amino-4-oxo-2-(phenylmethoxycarbonylamino)butanoic acid IUPAC Name: 4-amino-4-oxo-2-(phenylmethoxycarbonylamino)butanoic acid Traditional Name: 4-amino-2-(benzyloxycarbonylamino)-4-keto-butyric acid Formula: C24H28N4O10 MolecularWeight: 532.49992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC(=O)N)C(=O)O.C1=CC=C(C=C1)COC(=O)NC(CC(=O)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC(=O)N)C(=O)O.C1=CC=C(C=C1)COC(=O)NC(CC(=O)N)C(=O)O

InChI

InChI=1S/2C12H14N2O5/c2*13-10(15)6-9(11(16)17)14-12(18)19-7-8-4-2-1-3-5-8/h2*1-5,9H,6-7H2,(H2,13,15)(H,14,18)(H,16,17)