5-iodanyl-2-(1-phenylethylcarbamoylamino)benzoic acid

Systemtic Name: 5-iodanyl-2-(1-phenylethylcarbamoylamino)benzoic acid Openeye Name: 5-iodo-2-(1-phenylethylcarbamoylamino)benzoic acid CAS Name: 5-iodo-2-[[oxo-(1-phenylethylamino)methyl]amino]benzoic acid IUPAC Name: 5-iodo-2-(1-phenylethylcarbamoylamino)benzoic acid Traditional Name: 5-iodo-2-(1-phenylethylcarbamoylamino)benzoic acid Formula: C16H15IN2O3 MolecularWeight: 410.20637

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)NC2=C(C=C(C=C2)I)C(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)NC2=C(C=C(C=C2)I)C(=O)O

InChI

InChI=1S/C16H15IN2O3/c1-10(11-5-3-2-4-6-11)18-16(22)19-14-8-7-12(17)9-13(14)15(20)21/h2-10H,1H3,(H,20,21)(H2,18,19,22)