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

Systemtic Name: [(1S)-1-(3,4-dimethylphenyl)-2-(2-methylphenoxy)ethyl]azanium Openeye Name: [(1S)-1-(3,4-dimethylphenyl)-2-(2-methylphenoxy)ethyl]ammonium CAS Name: [(1S)-1-(3,4-dimethylphenyl)-2-(2-methylphenoxy)ethyl]ammonium IUPAC Name: [(1S)-1-(3,4-dimethylphenyl)-2-(2-methylphenoxy)ethyl]azanium Traditional Name: [(1S)-1-(3,4-dimethylphenyl)-2-(2-methylphenoxy)ethyl]ammonium Formula: C17H22NO+ MolecularWeight: 256.36268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(COC2=CC=CC=C2C)[NH3+])C

Isomeric SMILES

CC1=C(C=C(C=C1)[C@@H](COC2=CC=CC=C2C)[NH3+])C

InChI

InChI=1S/C17H21NO/c1-12-8-9-15(10-14(12)3)16(18)11-19-17-7-5-4-6-13(17)2/h4-10,16H,11,18H2,1-3H3/p+1/t16-/m1/s1