4-[(2-iodanylphenyl)amino]-4-oxidanylidene-2-(1-phenylethyl)butanoic acid

Systemtic Name: 4-[(2-iodanylphenyl)amino]-4-oxidanylidene-2-(1-phenylethyl)butanoic acid Openeye Name: 4-(2-iodoanilino)-4-oxo-2-(1-phenylethyl)butanoic acid CAS Name: 4-(2-iodoanilino)-4-oxo-2-(1-phenylethyl)butanoic acid IUPAC Name: 4-(2-iodoanilino)-4-oxo-2-(1-phenylethyl)butanoic acid Traditional Name: 4-(2-iodoanilino)-4-keto-2-(1-phenylethyl)butyric acid Formula: C18H18INO3 MolecularWeight: 423.24489

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C(CC(=O)NC2=CC=CC=C2I)C(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1)C(CC(=O)NC2=CC=CC=C2I)C(=O)O

InChI

InChI=1S/C18H18INO3/c1-12(13-7-3-2-4-8-13)14(18(22)23)11-17(21)20-16-10-6-5-9-15(16)19/h2-10,12,14H,11H2,1H3,(H,20,21)(H,22,23)