[(2S)-heptan-2-yl]-[(4-methoxyphenyl)methyl]azanium

Systemtic Name: [(2S)-heptan-2-yl]-[(4-methoxyphenyl)methyl]azanium Openeye Name: (4-methoxyphenyl)methyl-[(1S)-1-methylhexyl]ammonium CAS Name: [(2S)-heptan-2-yl]-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: [(2S)-heptan-2-yl]-[(4-methoxyphenyl)methyl]azanium Traditional Name: [(1S)-1-methylhexyl]-p-anisyl-ammonium Formula: C15H26NO+ MolecularWeight: 236.37304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25NO/c1-4-5-6-7-13(2)16-12-14-8-10-15(17-3)11-9-14/h8-11,13,16H,4-7,12H2,1-3H3/p+1/t13-/m0/s1