[(1S)-1-(3,4-dimethylphenyl)-2-phenethyloxy-ethyl]azanium

Systemtic Name: [(1S)-1-(3,4-dimethylphenyl)-2-phenethyloxy-ethyl]azanium Openeye Name: [(1S)-1-(3,4-dimethylphenyl)-2-phenethyloxy-ethyl]ammonium CAS Name: [(1S)-1-(3,4-dimethylphenyl)-2-phenethyloxyethyl]ammonium IUPAC Name: [(1S)-1-(3,4-dimethylphenyl)-2-phenethyloxyethyl]azanium Traditional Name: [(1S)-1-(3,4-dimethylphenyl)-2-phenethyloxy-ethyl]ammonium Formula: C18H24NO+ MolecularWeight: 270.38926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(COCCC2=CC=CC=C2)[NH3+])C

Isomeric SMILES

CC1=C(C=C(C=C1)[C@@H](COCCC2=CC=CC=C2)[NH3+])C

InChI

InChI=1S/C18H23NO/c1-14-8-9-17(12-15(14)2)18(19)13-20-11-10-16-6-4-3-5-7-16/h3-9,12,18H,10-11,13,19H2,1-2H3/p+1/t18-/m1/s1