(2-butoxy-5-methyl-phenyl)methyl-bis(2-hydroxyethyl)azanium

Systemtic Name: (2-butoxy-5-methyl-phenyl)methyl-bis(2-hydroxyethyl)azanium Openeye Name: (2-butoxy-5-methyl-phenyl)methyl-bis(2-hydroxyethyl)ammonium CAS Name: (2-butoxy-5-methylphenyl)methyl-bis(2-hydroxyethyl)ammonium IUPAC Name: (2-butoxy-5-methylphenyl)methyl-bis(2-hydroxyethyl)azanium Traditional Name: (2-butoxy-5-methyl-benzyl)-bis(2-hydroxyethyl)ammonium Formula: C16H28NO3+ MolecularWeight: 282.39842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C)C[NH+](CCO)CCO

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C)C[NH+](CCO)CCO

InChI

InChI=1S/C16H27NO3/c1-3-4-11-20-16-6-5-14(2)12-15(16)13-17(7-9-18)8-10-19/h5-6,12,18-19H,3-4,7-11,13H2,1-2H3/p+1