methyl 3-[2-(4-iodanylphenoxy)ethanoylamino]-2-methyl-benzoate

Systemtic Name: methyl 3-[2-(4-iodanylphenoxy)ethanoylamino]-2-methyl-benzoate Openeye Name: methyl 3-[[2-(4-iodophenoxy)acetyl]amino]-2-methyl-benzoate CAS Name: 3-[[2-(4-iodophenoxy)-1-oxoethyl]amino]-2-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-(4-iodophenoxy)acetyl]amino]-2-methylbenzoate Traditional Name: 3-[[2-(4-iodophenoxy)acetyl]amino]-2-methyl-benzoic acid methyl ester Formula: C17H16INO4 MolecularWeight: 425.21771

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)COC2=CC=C(C=C2)I)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)COC2=CC=C(C=C2)I)C(=O)OC

InChI

InChI=1S/C17H16INO4/c1-11-14(17(21)22-2)4-3-5-15(11)19-16(20)10-23-13-8-6-12(18)7-9-13/h3-9H,10H2,1-2H3,(H,19,20)