(3-methoxy-4-oxidanyl-phenyl)methyl-[(2R)-5-methylhexan-2-yl]azanium

Systemtic Name: (3-methoxy-4-oxidanyl-phenyl)methyl-[(2R)-5-methylhexan-2-yl]azanium Openeye Name: [(1R)-1,4-dimethylpentyl]-[(4-hydroxy-3-methoxy-phenyl)methyl]ammonium CAS Name: (4-hydroxy-3-methoxyphenyl)methyl-[(2R)-5-methylhexan-2-yl]ammonium IUPAC Name: (4-hydroxy-3-methoxyphenyl)methyl-[(2R)-5-methylhexan-2-yl]azanium Traditional Name: [(1R)-1,4-dimethylpentyl]-vanillyl-ammonium Formula: C15H26NO2+ MolecularWeight: 252.37244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)[NH2+]CC1=CC(=C(C=C1)O)OC

Isomeric SMILES

C[C@H](CCC(C)C)[NH2+]CC1=CC(=C(C=C1)O)OC

InChI

InChI=1S/C15H25NO2/c1-11(2)5-6-12(3)16-10-13-7-8-14(17)15(9-13)18-4/h7-9,11-12,16-17H,5-6,10H2,1-4H3/p+1/t12-/m1/s1