tert-butyl N-[N'-(5-iodanylpentyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]carbamate

Systemtic Name: tert-butyl N-[N'-(5-iodanylpentyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]carbamate Openeye Name: tert-butyl N-[N-tert-butoxycarbonyl-N'-(5-iodopentyl)carbamimidoyl]carbamate CAS Name: N-[5-iodopentylimino-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[N'-(5-iodopentyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]carbamate Traditional Name: N-[N-tert-butoxycarbonyl-N'-(5-iodopentyl)amidino]carbamic acid tert-butyl ester Formula: C16H30IN3O4 MolecularWeight: 455.33157

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(=NCCCCCI)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NC(=NCCCCCI)NC(=O)OC(C)(C)C

InChI

InChI=1S/C16H30IN3O4/c1-15(2,3)23-13(21)19-12(18-11-9-7-8-10-17)20-14(22)24-16(4,5)6/h7-11H2,1-6H3,(H2,18,19,20,21,22)