3-carboxy-6-oxidanyl-3-(2-oxidanylpropyl)-2-(trimethylazaniumyl)heptanoate

Systemtic Name: 3-carboxy-6-oxidanyl-3-(2-oxidanylpropyl)-2-(trimethylazaniumyl)heptanoate Openeye Name: 3-carboxy-6-hydroxy-3-(2-hydroxypropyl)-2-(trimethylammonio)heptanoate CAS Name: 3-carboxy-6-hydroxy-3-(2-hydroxypropyl)-2-(trimethylammonio)heptanoate IUPAC Name: 3-carboxy-6-hydroxy-3-(2-hydroxypropyl)-2-(trimethylazaniumyl)heptanoate Traditional Name: 3-carboxy-6-hydroxy-3-(2-hydroxypropyl)-2-(trimethylammonio)enanthate Formula: C14H27NO6 MolecularWeight: 305.36728

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(CC(C)O)(C(C(=O)[O-])[N+](C)(C)C)C(=O)O)O

Isomeric SMILES

CC(CCC(CC(C)O)(C(C(=O)[O-])[N+](C)(C)C)C(=O)O)O

InChI

InChI=1S/C14H27NO6/c1-9(16)6-7-14(13(20)21,8-10(2)17)11(12(18)19)15(3,4)5/h9-11,16-17H,6-8H2,1-5H3,(H-,18,19,20,21)