2-(4-methoxyphenyl)ethyl-[(2S)-octan-2-yl]azanium

Systemtic Name: 2-(4-methoxyphenyl)ethyl-[(2S)-octan-2-yl]azanium Openeye Name: 2-(4-methoxyphenyl)ethyl-[(1S)-1-methylheptyl]ammonium CAS Name: 2-(4-methoxyphenyl)ethyl-[(2S)-octan-2-yl]ammonium IUPAC Name: 2-(4-methoxyphenyl)ethyl-[(2S)-octan-2-yl]azanium Traditional Name: 2-(4-methoxyphenyl)ethyl-[(1S)-1-methylheptyl]ammonium Formula: C17H30NO+ MolecularWeight: 264.4262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)[NH2+]CCC1=CC=C(C=C1)OC

Isomeric SMILES

CCCCCC[C@H](C)[NH2+]CCC1=CC=C(C=C1)OC

InChI

InChI=1S/C17H29NO/c1-4-5-6-7-8-15(2)18-14-13-16-9-11-17(19-3)12-10-16/h9-12,15,18H,4-8,13-14H2,1-3H3/p+1/t15-/m0/s1