N-[(E)-heptadec-8-enyl]-4-propanoyl-piperazine-1-carboxamide; 2,2,5,5-tetramethyl-1,3-dioxane-4-carboxamide

Systemtic Name: N-[(E)-heptadec-8-enyl]-4-propanoyl-piperazine-1-carboxamide; 2,2,5,5-tetramethyl-1,3-dioxane-4-carboxamide Openeye Name: N-[(E)-heptadec-8-enyl]-4-propanoyl-piperazine-1-carboxamide; 2,2,5,5-tetramethyl-1,3-dioxane-4-carboxamide CAS Name: N-[(E)-heptadec-8-enyl]-4-(1-oxopropyl)-1-piperazinecarboxamide; 2,2,5,5-tetramethyl-1,3-dioxane-4-carboxamide IUPAC Name: N-[(E)-heptadec-8-enyl]-4-propanoylpiperazine-1-carboxamide; 2,2,5,5-tetramethyl-1,3-dioxane-4-carboxamide Traditional Name: N-[(E)-heptadec-8-enyl]-4-propionyl-piperazine-1-carboxamide; 2,2,5,5-tetramethyl-1,3-dioxane-4-carboxamide Formula: C34H64N4O5 MolecularWeight: 608.89576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCNC(=O)N1CCN(CC1)C(=O)CC.CC1(COC(OC1C(=O)N)(C)C)C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCNC(=O)N1CCN(CC1)C(=O)CC.CC1(COC(OC1C(=O)N)(C)C)C

InChI

InChI=1S/C25H47N3O2.C9H17NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26-25(30)28-22-20-27(21-23-28)24(29)4-2;1-8(2)5-12-9(3,4)13-6(8)7(10)11/h11-12H,3-10,13-23H2,1-2H3,(H,26,30);6H,5H2,1-4H3,(H2,10,11)/b12-11+;