[2-[(diphenylmethyl)amino]-2-oxidanylidene-ethyl] 5-iodanyl-2-oxidanyl-benzoate

Systemtic Name: [2-[(diphenylmethyl)amino]-2-oxidanylidene-ethyl] 5-iodanyl-2-oxidanyl-benzoate Openeye Name: [2-(benzhydrylamino)-2-oxo-ethyl] 2-hydroxy-5-iodo-benzoate CAS Name: 2-hydroxy-5-iodobenzoic acid [2-[(diphenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-(benzhydrylamino)-2-oxoethyl] 2-hydroxy-5-iodobenzoate Traditional Name: 2-hydroxy-5-iodo-benzoic acid [2-(benzhydrylamino)-2-keto-ethyl] ester Formula: C22H18INO4 MolecularWeight: 487.28709

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)COC(=O)C3=C(C=CC(=C3)I)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)COC(=O)C3=C(C=CC(=C3)I)O

InChI

InChI=1S/C22H18INO4/c23-17-11-12-19(25)18(13-17)22(27)28-14-20(26)24-21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13,21,25H,14H2,(H,24,26)