trimethyl-[16-oxidanyl-14,17-bis(oxidanylidene)triacontan-15-yl]azanium

Systemtic Name: trimethyl-[16-oxidanyl-14,17-bis(oxidanylidene)triacontan-15-yl]azanium Openeye Name: (2-hydroxy-3-oxo-1-tetradecanoyl-hexadecyl)-trimethyl-ammonium CAS Name: (16-hydroxy-14,17-dioxotriacontan-15-yl)-trimethylammonium IUPAC Name: (16-hydroxy-14,17-dioxotriacontan-15-yl)-trimethylazanium Traditional Name: (2-hydroxy-3-keto-1-tetradecanoyl-hexadecyl)-trimethyl-ammonium Formula: C33H66NO3+ MolecularWeight: 524.88204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)C(C(C(=O)CCCCCCCCCCCCC)O)[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCC(=O)C(C(C(=O)CCCCCCCCCCCCC)O)[N+](C)(C)C

InChI

InChI=1S/C33H66NO3/c1-6-8-10-12-14-16-18-20-22-24-26-28-30(35)32(34(3,4)5)33(37)31(36)29-27-25-23-21-19-17-15-13-11-9-7-2/h32-33,37H,6-29H2,1-5H3/q+1