[3-carboxy-6-methyl-4-oxidanylidene-2-(11-oxidanylundecoxy)heptyl]-trimethyl-azanium

Systemtic Name: [3-carboxy-6-methyl-4-oxidanylidene-2-(11-oxidanylundecoxy)heptyl]-trimethyl-azanium Openeye Name: [3-carboxy-2-(11-hydroxyundecoxy)-6-methyl-4-oxo-heptyl]-trimethyl-ammonium CAS Name: [3-carboxy-2-(11-hydroxyundecoxy)-6-methyl-4-oxoheptyl]-trimethylammonium IUPAC Name: [3-carboxy-2-(11-hydroxyundecoxy)-6-methyl-4-oxoheptyl]-trimethylazanium Traditional Name: [3-carboxy-2-(11-hydroxyundecoxy)-4-keto-6-methyl-heptyl]-trimethyl-ammonium Formula: C23H46NO5+ MolecularWeight: 416.61504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C(C(C[N+](C)(C)C)OCCCCCCCCCCCO)C(=O)O

Isomeric SMILES

CC(C)CC(=O)C(C(C[N+](C)(C)C)OCCCCCCCCCCCO)C(=O)O

InChI

InChI=1S/C23H45NO5/c1-19(2)17-20(26)22(23(27)28)21(18-24(3,4)5)29-16-14-12-10-8-6-7-9-11-13-15-25/h19,21-22,25H,6-18H2,1-5H3/p+1