[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 4-methyl-3-oxidanyl-benzoate

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 4-methyl-3-oxidanyl-benzoate Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl] 3-hydroxy-4-methyl-benzoate CAS Name: 3-hydroxy-4-methylbenzoic acid [2-(3-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl] 3-hydroxy-4-methylbenzoate Traditional Name: 3-hydroxy-4-methyl-benzoic acid [2-(3-iodoanilino)-2-keto-ethyl] ester Formula: C16H14INO4 MolecularWeight: 411.19113

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)I)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)I)O

InChI

InChI=1S/C16H14INO4/c1-10-5-6-11(7-14(10)19)16(21)22-9-15(20)18-13-4-2-3-12(17)8-13/h2-8,19H,9H2,1H3,(H,18,20)