methyl 3-(4-iodophenyl)-2-[(phenylmethyl)amino]propanoate

Systemtic Name: methyl 3-(4-iodophenyl)-2-[(phenylmethyl)amino]propanoate Openeye Name: methyl 2-(benzylamino)-3-(4-iodophenyl)propanoate CAS Name: 3-(4-iodophenyl)-2-[(phenylmethyl)amino]propanoic acid methyl ester IUPAC Name: methyl 2-(benzylamino)-3-(4-iodophenyl)propanoate Traditional Name: 2-(benzylamino)-3-(4-iodophenyl)propionic acid methyl ester Formula: C17H18INO2 MolecularWeight: 395.23479

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)I)NCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CC1=CC=C(C=C1)I)NCC2=CC=CC=C2

InChI

InChI=1S/C17H18INO2/c1-21-17(20)16(11-13-7-9-15(18)10-8-13)19-12-14-5-3-2-4-6-14/h2-10,16,19H,11-12H2,1H3