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

Systemtic Name: (3R)-4-[(2-iodanylphenyl)amino]-3-[(4-methylphenyl)methyl]-4-oxidanylidene-butanoate Openeye Name: (3R)-4-(2-iodoanilino)-4-oxo-3-(p-tolylmethyl)butanoate CAS Name: (3R)-4-(2-iodoanilino)-3-[(4-methylphenyl)methyl]-4-oxobutanoate IUPAC Name: (3R)-4-(2-iodoanilino)-3-[(4-methylphenyl)methyl]-4-oxobutanoate Traditional Name: (3R)-4-(2-iodoanilino)-4-keto-3-(4-methylbenzyl)butyrate Formula: C18H17INO3- MolecularWeight: 422.23695

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(CC(=O)[O-])C(=O)NC2=CC=CC=C2I

Isomeric SMILES

CC1=CC=C(C=C1)C[C@H](CC(=O)[O-])C(=O)NC2=CC=CC=C2I

InChI

InChI=1S/C18H18INO3/c1-12-6-8-13(9-7-12)10-14(11-17(21)22)18(23)20-16-5-3-2-4-15(16)19/h2-9,14H,10-11H2,1H3,(H,20,23)(H,21,22)/p-1/t14-/m1/s1