[1-(3-iodanylphenyl)-1-pyridin-2-yl-ethyl] 2-[(3-methoxyphenyl)methylamino]propanoate

Systemtic Name: [1-(3-iodanylphenyl)-1-pyridin-2-yl-ethyl] 2-[(3-methoxyphenyl)methylamino]propanoate Openeye Name: [1-(3-iodophenyl)-1-(2-pyridyl)ethyl] 2-[(3-methoxyphenyl)methylamino]propanoate CAS Name: 2-[(3-methoxyphenyl)methylamino]propanoic acid [1-(3-iodophenyl)-1-(2-pyridinyl)ethyl] ester IUPAC Name: [1-(3-iodophenyl)-1-pyridin-2-ylethyl] 2-[(3-methoxyphenyl)methylamino]propanoate Traditional Name: 2-(m-anisylamino)propionic acid [1-(3-iodophenyl)-1-(2-pyridyl)ethyl] ester Formula: C24H25IN2O3 MolecularWeight: 516.37137

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)(C1=CC(=CC=C1)I)C2=CC=CC=N2)NCC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C(=O)OC(C)(C1=CC(=CC=C1)I)C2=CC=CC=N2)NCC3=CC(=CC=C3)OC

InChI

InChI=1S/C24H25IN2O3/c1-17(27-16-18-8-6-11-21(14-18)29-3)23(28)30-24(2,22-12-4-5-13-26-22)19-9-7-10-20(25)15-19/h4-15,17,27H,16H2,1-3H3