(phenylmethyl) 3-[(2-azanyl-4-iodanyl-phenyl)carbonylamino]propanoate

Systemtic Name: (phenylmethyl) 3-[(2-azanyl-4-iodanyl-phenyl)carbonylamino]propanoate Openeye Name: benzyl 3-[(2-amino-4-iodo-benzoyl)amino]propanoate CAS Name: 3-[[(2-amino-4-iodophenyl)-oxomethyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[(2-amino-4-iodobenzoyl)amino]propanoate Traditional Name: 3-[(2-amino-4-iodo-benzoyl)amino]propionic acid benzyl ester Formula: C17H17IN2O3 MolecularWeight: 424.23295

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCNC(=O)C2=C(C=C(C=C2)I)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCNC(=O)C2=C(C=C(C=C2)I)N

InChI

InChI=1S/C17H17IN2O3/c18-13-6-7-14(15(19)10-13)17(22)20-9-8-16(21)23-11-12-4-2-1-3-5-12/h1-7,10H,8-9,11,19H2,(H,20,22)