ethyl 3-(4-iodophenyl)-3-[(phenylmethyl)amino]propanoate

Systemtic Name: ethyl 3-(4-iodophenyl)-3-[(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-(benzylamino)-3-(4-iodophenyl)propanoate CAS Name: 3-(4-iodophenyl)-3-[(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-(benzylamino)-3-(4-iodophenyl)propanoate Traditional Name: 3-(benzylamino)-3-(4-iodophenyl)propionic acid ethyl ester Formula: C18H20INO2 MolecularWeight: 409.26137

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=C(C=C1)I)NCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CC(C1=CC=C(C=C1)I)NCC2=CC=CC=C2

InChI

InChI=1S/C18H20INO2/c1-2-22-18(21)12-17(15-8-10-16(19)11-9-15)20-13-14-6-4-3-5-7-14/h3-11,17,20H,2,12-13H2,1H3