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

Systemtic Name: [(1S)-1-(3,4-dimethylphenyl)ethyl]-(3-oxidanylpropyl)azanium Openeye Name: [(1S)-1-(3,4-dimethylphenyl)ethyl]-(3-hydroxypropyl)ammonium CAS Name: [(1S)-1-(3,4-dimethylphenyl)ethyl]-(3-hydroxypropyl)ammonium IUPAC Name: [(1S)-1-(3,4-dimethylphenyl)ethyl]-(3-hydroxypropyl)azanium Traditional Name: [(1S)-1-(3,4-dimethylphenyl)ethyl]-(3-hydroxypropyl)ammonium Formula: C13H22NO+ MolecularWeight: 208.31988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)[NH2+]CCCO)C

Isomeric SMILES

CC1=C(C=C(C=C1)[C@H](C)[NH2+]CCCO)C

InChI

InChI=1S/C13H21NO/c1-10-5-6-13(9-11(10)2)12(3)14-7-4-8-15/h5-6,9,12,14-15H,4,7-8H2,1-3H3/p+1/t12-/m0/s1