2-[1-[(4-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl]oxy-5-iodanyl-benzoic acid

Systemtic Name: 2-[1-[(4-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl]oxy-5-iodanyl-benzoic acid Openeye Name: 2-[2-[(4-chlorophenyl)methylamino]-1-methyl-2-oxo-ethoxy]-5-iodo-benzoic acid CAS Name: 2-[1-[(4-chlorophenyl)methylamino]-1-oxopropan-2-yl]oxy-5-iodobenzoic acid IUPAC Name: 2-[1-[(4-chlorophenyl)methylamino]-1-oxopropan-2-yl]oxy-5-iodobenzoic acid Traditional Name: 2-[2-[(4-chlorobenzyl)amino]-2-keto-1-methyl-ethoxy]-5-iodo-benzoic acid Formula: C17H15ClINO4 MolecularWeight: 459.66277

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)Cl)OC2=C(C=C(C=C2)I)C(=O)O

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)Cl)OC2=C(C=C(C=C2)I)C(=O)O

InChI

InChI=1S/C17H15ClINO4/c1-10(16(21)20-9-11-2-4-12(18)5-3-11)24-15-7-6-13(19)8-14(15)17(22)23/h2-8,10H,9H2,1H3,(H,20,21)(H,22,23)