[(1S)-1-(5-methoxy-2-oxidanyl-phenyl)ethyl]-(3-oxidanylpropyl)azanium

Systemtic Name: [(1S)-1-(5-methoxy-2-oxidanyl-phenyl)ethyl]-(3-oxidanylpropyl)azanium Openeye Name: [(1S)-1-(2-hydroxy-5-methoxy-phenyl)ethyl]-(3-hydroxypropyl)ammonium CAS Name: [(1S)-1-(2-hydroxy-5-methoxyphenyl)ethyl]-(3-hydroxypropyl)ammonium IUPAC Name: [(1S)-1-(2-hydroxy-5-methoxyphenyl)ethyl]-(3-hydroxypropyl)azanium Traditional Name: [(1S)-1-(2-hydroxy-5-methoxy-phenyl)ethyl]-(3-hydroxypropyl)ammonium Formula: C12H20NO3+ MolecularWeight: 226.2921

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO3/c1-9(13-6-3-7-14)11-8-10(16-2)4-5-12(11)15/h4-5,8-9,13-15H,3,6-7H2,1-2H3/p+1/t9-/m0/s1