3-[[(1S)-1-(3-methoxy-4-oxidanyl-phenyl)ethyl]azaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[[(1S)-1-(3-methoxy-4-oxidanyl-phenyl)ethyl]azaniumyl]propyl-dimethyl-azanium Openeye Name: 3-[[(1S)-1-(4-hydroxy-3-methoxy-phenyl)ethyl]ammonio]propyl-dimethyl-ammonium CAS Name: 3-[[(1S)-1-(4-hydroxy-3-methoxyphenyl)ethyl]ammonio]propyl-dimethylammonium IUPAC Name: 3-[[(1S)-1-(4-hydroxy-3-methoxyphenyl)ethyl]azaniumyl]propyl-dimethylazanium Traditional Name: 3-[[(1S)-1-(4-hydroxy-3-methoxy-phenyl)ethyl]ammonio]propyl-dimethyl-ammonium Formula: C14H26N2O2+2 MolecularWeight: 254.36844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H24N2O2/c1-11(15-8-5-9-16(2)3)12-6-7-13(17)14(10-12)18-4/h6-7,10-11,15,17H,5,8-9H2,1-4H3/p+2/t11-/m0/s1