[(1S)-1-(4-methyl-2-oxidanyl-phenyl)ethyl]-(3-oxidanylpropyl)azanium

Systemtic Name: [(1S)-1-(4-methyl-2-oxidanyl-phenyl)ethyl]-(3-oxidanylpropyl)azanium Openeye Name: [(1S)-1-(2-hydroxy-4-methyl-phenyl)ethyl]-(3-hydroxypropyl)ammonium CAS Name: [(1S)-1-(2-hydroxy-4-methylphenyl)ethyl]-(3-hydroxypropyl)ammonium IUPAC Name: [(1S)-1-(2-hydroxy-4-methylphenyl)ethyl]-(3-hydroxypropyl)azanium Traditional Name: [(1S)-1-(2-hydroxy-4-methyl-phenyl)ethyl]-(3-hydroxypropyl)ammonium Formula: C12H20NO2+ MolecularWeight: 210.2927

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO2/c1-9-4-5-11(12(15)8-9)10(2)13-6-3-7-14/h4-5,8,10,13-15H,3,6-7H2,1-2H3/p+1/t10-/m0/s1