2-[4-iodanyl-2-[(4-methoxyphenyl)methylcarbamoyl]phenyl]benzoic acid

Systemtic Name: 2-[4-iodanyl-2-[(4-methoxyphenyl)methylcarbamoyl]phenyl]benzoic acid Openeye Name: 2-[4-iodo-2-[(4-methoxyphenyl)methylcarbamoyl]phenyl]benzoic acid CAS Name: 2-[4-iodo-2-[[(4-methoxyphenyl)methylamino]-oxomethyl]phenyl]benzoic acid IUPAC Name: 2-[4-iodo-2-[(4-methoxyphenyl)methylcarbamoyl]phenyl]benzoic acid Traditional Name: 2-[4-iodo-2-(p-anisylcarbamoyl)phenyl]benzoic acid Formula: C22H18INO4 MolecularWeight: 487.28709

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)I)C3=CC=CC=C3C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)I)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C22H18INO4/c1-28-16-9-6-14(7-10-16)13-24-21(25)20-12-15(23)8-11-18(20)17-4-2-3-5-19(17)22(26)27/h2-12H,13H2,1H3,(H,24,25)(H,26,27)