2-chloranylethanal; 3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 2-chloranylethanal; 3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-3-phenyl-propanoic acid; 2-chloroacetaldehyde CAS Name: 2-chloroacetaldehyde; 3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 2-chloroacetaldehyde; 3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-3-phenyl-propionic acid; 2-chloroacetaldehyde Formula: C19H20ClNO5 MolecularWeight: 377.8188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC2=CC=CC=C2.C(C=O)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC2=CC=CC=C2.C(C=O)Cl

InChI

InChI=1S/C17H17NO4.C2H3ClO/c19-16(20)15(11-13-7-3-1-4-8-13)18-17(21)22-12-14-9-5-2-6-10-14;3-1-2-4/h1-10,15H,11-12H2,(H,18,21)(H,19,20);2H,1H2