2-ethylhexyl-(2-hydroxyethyloxycarbonyl)-methanidyl-methoxy-azanium

Systemtic Name: 2-ethylhexyl-(2-hydroxyethyloxycarbonyl)-methanidyl-methoxy-azanium Openeye Name: 2-ethylhexyl-(2-hydroxyethoxycarbonyl)-methanidyl-methoxy-ammonium CAS Name: 2-ethylhexyl-[2-hydroxyethoxy(oxo)methyl]-methanidyl-methoxyammonium IUPAC Name: 2-ethylhexyl-(2-hydroxyethoxycarbonyl)-methanidyl-methoxyazanium Traditional Name: 2-ethylhexyl-(2-hydroxyethoxycarbonyl)-methanidyl-methoxy-ammonium Formula: C13H27NO4 MolecularWeight: 261.35778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[N+]([CH2-])(C(=O)OCCO)OC

Isomeric SMILES

CCCCC(CC)C[N+]([CH2-])(C(=O)OCCO)OC

InChI

InChI=1S/C13H27NO4/c1-5-7-8-12(6-2)11-14(3,17-4)13(16)18-10-9-15/h12,15H,3,5-11H2,1-2,4H3