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3,7-dimethyloct-6-enyl 4-(1-adamantylcarbamoylamino)butanoate

3,7-dimethyloct-6-enyl 4-(1-adamantylcarbamoylamino)butanoate

Systemtic Name:3,7-dimethyloct-6-enyl 4-(1-adamantylcarbamoylamino)butanoate
Openeye Name:3,7-dimethyloct-6-enyl 4-(1-adamantylcarbamoylamino)butanoate
CAS Name:4-[[(1-adamantylamino)-oxomethyl]amino]butanoic acid 3,7-dimethyloct-6-enyl ester
IUPAC Name:3,7-dimethyloct-6-enyl 4-(1-adamantylcarbamoylamino)butanoate
Traditional Name:4-(1-adamantylcarbamoylamino)butyric acid 3,7-dimethyloct-6-enyl ester
Formula: C25H42N2O3
MolecularWeight: 418.61258
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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=C(C)C)CCOC(=O)CCCNC(=O)NC12CC3CC(C1)CC(C3)C2


Isomeric SMILES

CC(CCC=C(C)C)CCOC(=O)CCCNC(=O)NC12CC3CC(C1)CC(C3)C2


InChI

InChI=1S/C25H42N2O3/c1-18(2)6-4-7-19(3)9-11-30-23(28)8-5-10-26-24(29)27-25-15-20-12-21(16-25)14-22(13-20)17-25/h6,19-22H,4-5,7-17H2,1-3H3,(H2,26,27,29)


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