[(2S)-3-(3,4-dimethylphenoxy)-2-oxidanyl-propyl]-[(1R)-1-phenylethyl]azanium

Systemtic Name: [(2S)-3-(3,4-dimethylphenoxy)-2-oxidanyl-propyl]-[(1R)-1-phenylethyl]azanium Openeye Name: [(2S)-3-(3,4-dimethylphenoxy)-2-hydroxy-propyl]-[(1R)-1-phenylethyl]ammonium CAS Name: [(2S)-3-(3,4-dimethylphenoxy)-2-hydroxypropyl]-[(1R)-1-phenylethyl]ammonium IUPAC Name: [(2S)-3-(3,4-dimethylphenoxy)-2-hydroxypropyl]-[(1R)-1-phenylethyl]azanium Traditional Name: [(2S)-3-(3,4-dimethylphenoxy)-2-hydroxy-propyl]-[(1R)-1-phenylethyl]ammonium Formula: C19H26NO2+ MolecularWeight: 300.41524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(C[NH2+]C(C)C2=CC=CC=C2)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC[C@H](C[NH2+][C@H](C)C2=CC=CC=C2)O)C

InChI

InChI=1S/C19H25NO2/c1-14-9-10-19(11-15(14)2)22-13-18(21)12-20-16(3)17-7-5-4-6-8-17/h4-11,16,18,20-21H,12-13H2,1-3H3/p+1/t16-,18+/m1/s1