2,6-bis(azanyl)-4-[1-azanyl-1-iodanyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-propan-2-yl]-5-oxidanylidene-heptanoic acid

Systemtic Name: 2,6-bis(azanyl)-4-[1-azanyl-1-iodanyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-propan-2-yl]-5-oxidanylidene-heptanoic acid Openeye Name: 2,6-diamino-4-[1-[amino(iodo)methyl]-2-(tert-butoxycarbonylamino)-2-hydroxy-ethyl]-5-oxo-heptanoic acid CAS Name: 2,6-diamino-4-[1-amino-3-hydroxy-1-iodo-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propan-2-yl]-5-oxoheptanoic acid IUPAC Name: 2,6-diamino-4-[1-amino-3-hydroxy-1-iodo-3-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl]-5-oxoheptanoic acid Traditional Name: 2,6-diamino-4-[1-[amino(iodo)methyl]-2-(tert-butoxycarbonylamino)-2-hydroxy-ethyl]-5-keto-enanthic acid Formula: C15H29IN4O6 MolecularWeight: 488.31843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(CC(C(=O)O)N)C(C(N)I)C(NC(=O)OC(C)(C)C)O)N

Isomeric SMILES

CC(C(=O)C(CC(C(=O)O)N)C(C(N)I)C(NC(=O)OC(C)(C)C)O)N

InChI

InChI=1S/C15H29IN4O6/c1-6(17)10(21)7(5-8(18)13(23)24)9(11(16)19)12(22)20-14(25)26-15(2,3)4/h6-9,11-12,22H,5,17-19H2,1-4H3,(H,20,25)(H,23,24)