2,2-diethyl-4-[(3-iodanylphenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 2,2-diethyl-4-[(3-iodanylphenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 2,2-diethyl-4-(3-iodoanilino)-4-oxo-butanoic acid CAS Name: 2,2-diethyl-4-(3-iodoanilino)-4-oxobutanoic acid IUPAC Name: 2,2-diethyl-4-(3-iodoanilino)-4-oxobutanoic acid Traditional Name: 2,2-diethyl-4-(3-iodoanilino)-4-keto-butyric acid Formula: C14H18INO3 MolecularWeight: 375.20209

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC(=O)NC1=CC(=CC=C1)I)C(=O)O

Isomeric SMILES

CCC(CC)(CC(=O)NC1=CC(=CC=C1)I)C(=O)O

InChI

InChI=1S/C14H18INO3/c1-3-14(4-2,13(18)19)9-12(17)16-11-7-5-6-10(15)8-11/h5-8H,3-4,9H2,1-2H3,(H,16,17)(H,18,19)