3-[[2-(4-iodophenyl)ethanoylamino]methyl-oxidanyl-phosphoryl]oxybenzoic acid

Systemtic Name: 3-[[2-(4-iodophenyl)ethanoylamino]methyl-oxidanyl-phosphoryl]oxybenzoic acid Openeye Name: 3-[hydroxy-[[[2-(4-iodophenyl)acetyl]amino]methyl]phosphoryl]oxybenzoic acid CAS Name: 3-[hydroxy-[[[2-(4-iodophenyl)-1-oxoethyl]amino]methyl]phosphoryl]oxybenzoic acid IUPAC Name: 3-[hydroxy-[[[2-(4-iodophenyl)acetyl]amino]methyl]phosphoryl]oxybenzoic acid Traditional Name: 3-[hydroxy-[[[2-(4-iodophenyl)acetyl]amino]methyl]phosphoryl]oxybenzoic acid Formula: C16H15INO6P MolecularWeight: 475.171631

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OP(=O)(CNC(=O)CC2=CC=C(C=C2)I)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)OP(=O)(CNC(=O)CC2=CC=C(C=C2)I)O)C(=O)O

InChI

InChI=1S/C16H15INO6P/c17-13-6-4-11(5-7-13)8-15(19)18-10-25(22,23)24-14-3-1-2-12(9-14)16(20)21/h1-7,9H,8,10H2,(H,18,19)(H,20,21)(H,22,23)