methyl 3-(2-iodanyl-3-methoxy-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]propanoate

Systemtic Name: methyl 3-(2-iodanyl-3-methoxy-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]propanoate Openeye Name: methyl 2-[benzyl(tert-butoxycarbonyl)amino]-3-(2-iodo-3-methoxy-phenyl)propanoate CAS Name: 3-(2-iodo-3-methoxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(phenylmethyl)amino]propanoic acid methyl ester IUPAC Name: methyl 2-[benzyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-(2-iodo-3-methoxyphenyl)propanoate Traditional Name: 2-[benzyl(tert-butoxycarbonyl)amino]-3-(2-iodo-3-methoxy-phenyl)propionic acid methyl ester Formula: C23H28INO5 MolecularWeight: 525.37659

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)C(CC2=C(C(=CC=C2)OC)I)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)C(CC2=C(C(=CC=C2)OC)I)C(=O)OC

InChI

InChI=1S/C23H28INO5/c1-23(2,3)30-22(27)25(15-16-10-7-6-8-11-16)18(21(26)29-5)14-17-12-9-13-19(28-4)20(17)24/h6-13,18H,14-15H2,1-5H3