4-(diethylaminomethyl)-2-hexadecoxy-6-propan-2-yl-2H-pyran-5-one

Systemtic Name: 4-(diethylaminomethyl)-2-hexadecoxy-6-propan-2-yl-2H-pyran-5-one Openeye Name: 4-(diethylaminomethyl)-2-hexadecoxy-6-isopropyl-2H-pyran-5-one CAS Name: 4-(diethylaminomethyl)-2-hexadecoxy-6-propan-2-yl-2H-pyran-5-one IUPAC Name: 4-(diethylaminomethyl)-2-hexadecoxy-6-propan-2-yl-2H-pyran-5-one Traditional Name: 2-cetyloxy-4-(diethylaminomethyl)-6-isopropyl-2H-pyran-5-one Formula: C29H55NO3 MolecularWeight: 465.7519

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1C=C(C(=O)C(O1)C(C)C)CN(CC)CC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1C=C(C(=O)C(O1)C(C)C)CN(CC)CC

InChI

InChI=1S/C29H55NO3/c1-6-9-10-11-12-13-14-15-16-17-18-19-20-21-22-32-27-23-26(24-30(7-2)8-3)28(31)29(33-27)25(4)5/h23,25,27,29H,6-22,24H2,1-5H3