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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)[NH2+]CC1=CC=CC=C1OC

Isomeric SMILES

CCCCC[C@H](C)[NH2+]CC1=CC=CC=C1OC

InChI

InChI=1S/C15H25NO/c1-4-5-6-9-13(2)16-12-14-10-7-8-11-15(14)17-3/h7-8,10-11,13,16H,4-6,9,12H2,1-3H3/p+1/t13-/m0/s1