2-[[(2S)-2-(3-methoxy-4-oxidanyl-phenyl)-2-oxidanyl-ethyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(2S)-2-(3-methoxy-4-oxidanyl-phenyl)-2-oxidanyl-ethyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[(2S)-2-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)ethyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(2S)-2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)ethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(2S)-2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)ethyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[(2S)-2-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)ethyl]amino]ethyl-dimethyl-ammonium Formula: C13H23N2O3+ MolecularWeight: 255.33332

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNCC(C1=CC(=C(C=C1)O)OC)O

Isomeric SMILES

C[NH+](C)CCNC[C@H](C1=CC(=C(C=C1)O)OC)O

InChI

InChI=1S/C13H22N2O3/c1-15(2)7-6-14-9-12(17)10-4-5-11(16)13(8-10)18-3/h4-5,8,12,14,16-17H,6-7,9H2,1-3H3/p+1/t12-/m1/s1