1-(4-hexyl-3-oxidanylidene-oxetan-2-yl)tridecan-2-yl 2-aminocarbonyl-3-methyl-but-2-enoate

Systemtic Name: 1-(4-hexyl-3-oxidanylidene-oxetan-2-yl)tridecan-2-yl 2-aminocarbonyl-3-methyl-but-2-enoate Openeye Name: 1-[(4-hexyl-3-oxo-oxetan-2-yl)methyl]dodecyl 2-carbamoyl-3-methyl-but-2-enoate CAS Name: 2-carbamoyl-3-methyl-2-butenoic acid 1-(4-hexyl-3-oxo-2-oxetanyl)tridecan-2-yl ester IUPAC Name: 1-(4-hexyl-3-oxooxetan-2-yl)tridecan-2-yl 2-carbamoyl-3-methylbut-2-enoate Traditional Name: 2-carbamoyl-3-methyl-but-2-enoic acid 1-[(4-hexyl-3-keto-oxetan-2-yl)methyl]dodecyl ester Formula: C28H49NO5 MolecularWeight: 479.69236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC1C(=O)C(O1)CCCCCC)OC(=O)C(=C(C)C)C(=O)N

Isomeric SMILES

CCCCCCCCCCCC(CC1C(=O)C(O1)CCCCCC)OC(=O)C(=C(C)C)C(=O)N

InChI

InChI=1S/C28H49NO5/c1-5-7-9-11-12-13-14-15-16-18-22(33-28(32)25(21(3)4)27(29)31)20-24-26(30)23(34-24)19-17-10-8-6-2/h22-24H,5-20H2,1-4H3,(H2,29,31)