(phenylmethyl) (2S)-3-[3-iodanyl-4-[(4-methoxyphenyl)methoxy]phenyl]-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (phenylmethyl) (2S)-3-[3-iodanyl-4-[(4-methoxyphenyl)methoxy]phenyl]-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: benzyl (2S)-2-(benzyloxycarbonylamino)-3-[3-iodo-4-[(4-methoxyphenyl)methoxy]phenyl]propanoate CAS Name: (2S)-3-[3-iodo-4-[(4-methoxyphenyl)methoxy]phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-3-[3-iodo-4-[(4-methoxyphenyl)methoxy]phenyl]-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-(3-iodo-4-p-anisyloxy-phenyl)propionic acid benzyl ester Formula: C32H30INO6 MolecularWeight: 651.48817

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC2=C(C=C(C=C2)CC(C(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4)I

Isomeric SMILES

COC1=CC=C(C=C1)COC2=C(C=C(C=C2)C[C@@H](C(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4)I

InChI

InChI=1S/C32H30INO6/c1-37-27-15-12-25(13-16-27)20-38-30-17-14-26(18-28(30)33)19-29(31(35)39-21-23-8-4-2-5-9-23)34-32(36)40-22-24-10-6-3-7-11-24/h2-18,29H,19-22H2,1H3,(H,34,36)/t29-/m0/s1