[2-iodanyl-3-[(2-methylpropan-2-yl)oxycarbonyl-prop-2-enyl-amino]phenyl]methyl ethanoate

Systemtic Name: [2-iodanyl-3-[(2-methylpropan-2-yl)oxycarbonyl-prop-2-enyl-amino]phenyl]methyl ethanoate Openeye Name: [3-[allyl(tert-butoxycarbonyl)amino]-2-iodo-phenyl]methyl acetate CAS Name: acetic acid [2-iodo-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]-prop-2-enylamino]phenyl]methyl ester IUPAC Name: [2-iodo-3-[(2-methylpropan-2-yl)oxycarbonyl-prop-2-enylamino]phenyl]methyl acetate Traditional Name: acetic acid [3-[allyl(tert-butoxycarbonyl)amino]-2-iodo-benzyl] ester Formula: C17H22INO4 MolecularWeight: 431.26535

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C(C(=CC=C1)N(CC=C)C(=O)OC(C)(C)C)I

Isomeric SMILES

CC(=O)OCC1=C(C(=CC=C1)N(CC=C)C(=O)OC(C)(C)C)I

InChI

InChI=1S/C17H22INO4/c1-6-10-19(16(21)23-17(3,4)5)14-9-7-8-13(15(14)18)11-22-12(2)20/h6-9H,1,10-11H2,2-5H3