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Reference substances

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IUPAC name:
(Z)-(butan-2-ylidene)amino N-(3-{[3,5-bis({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)carbamate

Inventory

Synonyms

Molecular and structural information

Molecular formula:
C48H81N9O9
Molecular weight:
928.24
SMILES notation:
CC/C(=N\OC(=O)NC1CC(CC(C1)(C)C)(Cn2c(=O)n(c(=O)n(c2=O)CC3(CC(CC(C3)NC(=O)O/N=C(\CC)/C)(C)C)C)CC4(CC(CC(C4)NC(=O)O/N=C(\CC)/C)(C)C)C)C)/C
InChl:
InChI=1/C48H81N9O9/c1-16-31(4)52-64-37(58)49-34-19-43(7,8)25-46(13,22-34)28-55-40(61)56(29-47(14)23-35(20-44(9,10)26-47)50-38(59)65-53-32(5)17-2)42(63)57(41(55)62)30-48(15)24-36(21-45(11,12)27-48)51-39(60)66-54-33(6)18-3/h34-36H,16-30H2,1-15H3,(H,49,58)(H,50,59)(H,51,60)/b52-31-,53-32-,54-33-
Structural formula:
Chemical structure

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