[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] pentanoate

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] pentanoate Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl] pentanoate CAS Name: pentanoic acid [2-(3-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl] pentanoate Traditional Name: valeric acid [2-(3-iodoanilino)-2-keto-ethyl] ester Formula: C13H16INO3 MolecularWeight: 361.17551

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OCC(=O)NC1=CC(=CC=C1)I

Isomeric SMILES

CCCCC(=O)OCC(=O)NC1=CC(=CC=C1)I

InChI

InChI=1S/C13H16INO3/c1-2-3-7-13(17)18-9-12(16)15-11-6-4-5-10(14)8-11/h4-6,8H,2-3,7,9H2,1H3,(H,15,16)