[2-[(2-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 4-butoxybenzoate

Systemtic Name: [2-[(2-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 4-butoxybenzoate Openeye Name: [2-(2-iodoanilino)-2-oxo-ethyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [2-(2-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-iodoanilino)-2-oxoethyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-(2-iodoanilino)-2-keto-ethyl] ester Formula: C19H20INO4 MolecularWeight: 453.27087

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC=CC=C2I

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC=CC=C2I

InChI

InChI=1S/C19H20INO4/c1-2-3-12-24-15-10-8-14(9-11-15)19(23)25-13-18(22)21-17-7-5-4-6-16(17)20/h4-11H,2-3,12-13H2,1H3,(H,21,22)