(3-ethoxy-2-oxidanyl-phenyl)methyl-[(2R)-5-methylhexan-2-yl]azanium

Systemtic Name: (3-ethoxy-2-oxidanyl-phenyl)methyl-[(2R)-5-methylhexan-2-yl]azanium Openeye Name: [(1R)-1,4-dimethylpentyl]-[(3-ethoxy-2-hydroxy-phenyl)methyl]ammonium CAS Name: (3-ethoxy-2-hydroxyphenyl)methyl-[(2R)-5-methylhexan-2-yl]ammonium IUPAC Name: (3-ethoxy-2-hydroxyphenyl)methyl-[(2R)-5-methylhexan-2-yl]azanium Traditional Name: [(1R)-1,4-dimethylpentyl]-(3-ethoxy-2-hydroxy-benzyl)ammonium Formula: C16H28NO2+ MolecularWeight: 266.39902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)C[NH2+]C(C)CCC(C)C

Isomeric SMILES

CCOC1=CC=CC(=C1O)C[NH2+][C@H](C)CCC(C)C

InChI

InChI=1S/C16H27NO2/c1-5-19-15-8-6-7-14(16(15)18)11-17-13(4)10-9-12(2)3/h6-8,12-13,17-18H,5,9-11H2,1-4H3/p+1/t13-/m1/s1