(2S)-3-(5-iodanyl-2-methoxy-phenyl)-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: (2S)-3-(5-iodanyl-2-methoxy-phenyl)-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: (2S)-2-(benzyloxycarbonylamino)-3-(5-iodo-2-methoxy-phenyl)propanoic acid CAS Name: (2S)-3-(5-iodo-2-methoxyphenyl)-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: (2S)-3-(5-iodo-2-methoxyphenyl)-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-(5-iodo-2-methoxy-phenyl)propionic acid Formula: C18H18INO5 MolecularWeight: 455.24369

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)I)CC(C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=C(C=C1)I)C[C@@H](C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H18INO5/c1-24-16-8-7-14(19)9-13(16)10-15(17(21)22)20-18(23)25-11-12-5-3-2-4-6-12/h2-9,15H,10-11H2,1H3,(H,20,23)(H,21,22)/t15-/m0/s1