(3R)-4-[(2-iodanylphenyl)amino]-4-oxidanylidene-3-(phenylmethyl)butanoate

Systemtic Name: (3R)-4-[(2-iodanylphenyl)amino]-4-oxidanylidene-3-(phenylmethyl)butanoate Openeye Name: (3R)-3-benzyl-4-(2-iodoanilino)-4-oxo-butanoate CAS Name: (3R)-4-(2-iodoanilino)-4-oxo-3-(phenylmethyl)butanoate IUPAC Name: (3R)-3-benzyl-4-(2-iodoanilino)-4-oxobutanoate Traditional Name: (3R)-3-benzyl-4-(2-iodoanilino)-4-keto-butyrate Formula: C17H15INO3- MolecularWeight: 408.21037

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC(=O)[O-])C(=O)NC2=CC=CC=C2I

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](CC(=O)[O-])C(=O)NC2=CC=CC=C2I

InChI

InChI=1S/C17H16INO3/c18-14-8-4-5-9-15(14)19-17(22)13(11-16(20)21)10-12-6-2-1-3-7-12/h1-9,13H,10-11H2,(H,19,22)(H,20,21)/p-1/t13-/m1/s1