decyl-dimethyl-[[(1S,2R)-2-(phenylcarbonyloxy)cyclohexyl]methyl]azanium

Systemtic Name: decyl-dimethyl-[[(1S,2R)-2-(phenylcarbonyloxy)cyclohexyl]methyl]azanium Openeye Name: [(1S,2R)-2-benzoyloxycyclohexyl]methyl-decyl-dimethyl-ammonium CAS Name: [(1S,2R)-2-benzoyloxycyclohexyl]methyl-decyl-dimethylammonium IUPAC Name: [(1S,2R)-2-benzoyloxycyclohexyl]methyl-decyl-dimethylazanium Traditional Name: [(1S,2R)-2-benzoyloxycyclohexyl]methyl-decyl-dimethyl-ammonium Formula: C26H44NO2+ MolecularWeight: 402.63306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[N+](C)(C)CC1CCCCC1OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCC[N+](C)(C)C[C@@H]1CCCC[C@H]1OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C26H44NO2/c1-4-5-6-7-8-9-10-16-21-27(2,3)22-24-19-14-15-20-25(24)29-26(28)23-17-12-11-13-18-23/h11-13,17-18,24-25H,4-10,14-16,19-22H2,1-3H3/q+1/t24-,25+/m0/s1