[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 3-quinolin-2-ylpropanoate

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 3-quinolin-2-ylpropanoate Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl] 3-(2-quinolyl)propanoate CAS Name: 3-(2-quinolinyl)propanoic acid [2-(3-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl] 3-quinolin-2-ylpropanoate Traditional Name: 3-(2-quinolyl)propionic acid [2-(3-iodoanilino)-2-keto-ethyl] ester Formula: C20H17IN2O3 MolecularWeight: 460.26505

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)CCC(=O)OCC(=O)NC3=CC(=CC=C3)I

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)CCC(=O)OCC(=O)NC3=CC(=CC=C3)I

InChI

InChI=1S/C20H17IN2O3/c21-15-5-3-6-17(12-15)23-19(24)13-26-20(25)11-10-16-9-8-14-4-1-2-7-18(14)22-16/h1-9,12H,10-11,13H2,(H,23,24)