5,5-dimethoxy-3-[phenylmethoxycarbonyl-(phenylmethyl)amino]pentanoic acid

Systemtic Name: 5,5-dimethoxy-3-[phenylmethoxycarbonyl-(phenylmethyl)amino]pentanoic acid Openeye Name: 3-[benzyl(benzyloxycarbonyl)amino]-5,5-dimethoxy-pentanoic acid CAS Name: 5,5-dimethoxy-3-[phenylmethoxycarbonyl-(phenylmethyl)amino]pentanoic acid IUPAC Name: 3-[benzyl(phenylmethoxycarbonyl)amino]-5,5-dimethoxypentanoic acid Traditional Name: 3-[benzyl(carbobenzoxy)amino]-5,5-dimethoxy-valeric acid Formula: C22H27NO6 MolecularWeight: 401.45288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(CC(CC(=O)O)N(CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2)OC

Isomeric SMILES

COC(CC(CC(=O)O)N(CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2)OC

InChI

InChI=1S/C22H27NO6/c1-27-21(28-2)14-19(13-20(24)25)23(15-17-9-5-3-6-10-17)22(26)29-16-18-11-7-4-8-12-18/h3-12,19,21H,13-16H2,1-2H3,(H,24,25)