[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 2,3,4-trimethoxybenzoate

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 2,3,4-trimethoxybenzoate Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl] 2,3,4-trimethoxybenzoate CAS Name: 2,3,4-trimethoxybenzoic acid [2-(3-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl] 2,3,4-trimethoxybenzoate Traditional Name: 2,3,4-trimethoxybenzoic acid [2-(3-iodoanilino)-2-keto-ethyl] ester Formula: C18H18INO6 MolecularWeight: 471.24309

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)I)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)I)OC)OC

InChI

InChI=1S/C18H18INO6/c1-23-14-8-7-13(16(24-2)17(14)25-3)18(22)26-10-15(21)20-12-6-4-5-11(19)9-12/h4-9H,10H2,1-3H3,(H,20,21)