phenylmethoxycarbonyl 2-azanyl-3-(3-iodanyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: phenylmethoxycarbonyl 2-azanyl-3-(3-iodanyl-4-oxidanyl-phenyl)propanoate Openeye Name: benzyloxycarbonyl 2-amino-3-(4-hydroxy-3-iodo-phenyl)propanoate CAS Name: 2-amino-3-(4-hydroxy-3-iodophenyl)propanoic acid phenylmethoxycarbonyl ester IUPAC Name: phenylmethoxycarbonyl 2-amino-3-(4-hydroxy-3-iodophenyl)propanoate Traditional Name: 2-amino-3-(4-hydroxy-3-iodo-phenyl)propionic acid carbobenzoxy ester Formula: C17H16INO5 MolecularWeight: 441.21711

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)OC(=O)C(CC2=CC(=C(C=C2)O)I)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)OC(=O)C(CC2=CC(=C(C=C2)O)I)N

InChI

InChI=1S/C17H16INO5/c18-13-8-12(6-7-15(13)20)9-14(19)16(21)24-17(22)23-10-11-4-2-1-3-5-11/h1-8,14,20H,9-10,19H2