(2S,3R)-4-[(4-iodophenyl)amino]-2-[(4-methoxyphenyl)methyl]-3-methyl-4-oxidanylidene-butanoate

Systemtic Name: (2S,3R)-4-[(4-iodophenyl)amino]-2-[(4-methoxyphenyl)methyl]-3-methyl-4-oxidanylidene-butanoate Openeye Name: (2S,3R)-4-(4-iodoanilino)-2-[(4-methoxyphenyl)methyl]-3-methyl-4-oxo-butanoate CAS Name: (2S,3R)-4-(4-iodoanilino)-2-[(4-methoxyphenyl)methyl]-3-methyl-4-oxobutanoate IUPAC Name: (2S,3R)-4-(4-iodoanilino)-2-[(4-methoxyphenyl)methyl]-3-methyl-4-oxobutanoate Traditional Name: (2S,3R)-4-(4-iodoanilino)-4-keto-3-methyl-2-p-anisyl-butyrate Formula: C19H19INO4- MolecularWeight: 452.26293

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC=C(C=C1)OC)C(=O)[O-])C(=O)NC2=CC=C(C=C2)I

Isomeric SMILES

C[C@H]([C@H](CC1=CC=C(C=C1)OC)C(=O)[O-])C(=O)NC2=CC=C(C=C2)I

InChI

InChI=1S/C19H20INO4/c1-12(18(22)21-15-7-5-14(20)6-8-15)17(19(23)24)11-13-3-9-16(25-2)10-4-13/h3-10,12,17H,11H2,1-2H3,(H,21,22)(H,23,24)/p-1/t12-,17+/m1/s1