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butyl 12-(1-adamantylcarbamoylamino)dodecanoate

butyl 12-(1-adamantylcarbamoylamino)dodecanoate

Systemtic Name:butyl 12-(1-adamantylcarbamoylamino)dodecanoate
Openeye Name:butyl 12-(1-adamantylcarbamoylamino)dodecanoate
CAS Name:12-[[(1-adamantylamino)-oxomethyl]amino]dodecanoic acid butyl ester
IUPAC Name:butyl 12-(1-adamantylcarbamoylamino)dodecanoate
Traditional Name:12-(1-adamantylcarbamoylamino)lauric acid butyl ester
Formula: C27H48N2O3
MolecularWeight: 448.68162
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(C1)CC(C3)C2


Isomeric SMILES

CCCCOC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(C1)CC(C3)C2


InChI

InChI=1S/C27H48N2O3/c1-2-3-15-32-25(30)13-11-9-7-5-4-6-8-10-12-14-28-26(31)29-27-19-22-16-23(20-27)18-24(17-22)21-27/h22-24H,2-21H2,1H3,(H2,28,29,31)


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