dibutyl-[(2R)-3-(3-methylphenoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: dibutyl-[(2R)-3-(3-methylphenoxy)-2-oxidanyl-propyl]azanium Openeye Name: dibutyl-[(2R)-2-hydroxy-3-(3-methylphenoxy)propyl]ammonium CAS Name: dibutyl-[(2R)-2-hydroxy-3-(3-methylphenoxy)propyl]ammonium IUPAC Name: dibutyl-[(2R)-2-hydroxy-3-(3-methylphenoxy)propyl]azanium Traditional Name: dibutyl-[(2R)-2-hydroxy-3-(3-methylphenoxy)propyl]ammonium Formula: C18H32NO2+ MolecularWeight: 294.45218

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CC(COC1=CC=CC(=C1)C)O

Isomeric SMILES

CCCC[NH+](CCCC)C[C@H](COC1=CC=CC(=C1)C)O

InChI

InChI=1S/C18H31NO2/c1-4-6-11-19(12-7-5-2)14-17(20)15-21-18-10-8-9-16(3)13-18/h8-10,13,17,20H,4-7,11-12,14-15H2,1-3H3/p+1/t17-/m1/s1