5-[2,6-bis(chloranyl)-3-phenylmethoxy-phenyl]carbonyloxy-4-oxidanylidene-3-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: 5-[2,6-bis(chloranyl)-3-phenylmethoxy-phenyl]carbonyloxy-4-oxidanylidene-3-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: 3-(benzyloxycarbonylamino)-5-(3-benzyloxy-2,6-dichloro-benzoyl)oxy-4-oxo-pentanoic acid CAS Name: 5-[(2,6-dichloro-3-phenylmethoxyphenyl)-oxomethoxy]-4-oxo-3-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: 5-(2,6-dichloro-3-phenylmethoxybenzoyl)oxy-4-oxo-3-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: 5-(3-benzoxy-2,6-dichloro-benzoyl)oxy-3-(benzyloxycarbonylamino)-4-keto-valeric acid Formula: C27H23Cl2NO8 MolecularWeight: 560.37942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C(=C(C=C2)Cl)C(=O)OCC(=O)C(CC(=O)O)NC(=O)OCC3=CC=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C(=C(C=C2)Cl)C(=O)OCC(=O)C(CC(=O)O)NC(=O)OCC3=CC=CC=C3)Cl

InChI

InChI=1S/C27H23Cl2NO8/c28-19-11-12-22(36-14-17-7-3-1-4-8-17)25(29)24(19)26(34)37-16-21(31)20(13-23(32)33)30-27(35)38-15-18-9-5-2-6-10-18/h1-12,20H,13-16H2,(H,30,35)(H,32,33)