3-[(4-methoxy-3-oxidanyl-phenyl)methylazaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[(4-methoxy-3-oxidanyl-phenyl)methylazaniumyl]propyl-dimethyl-azanium Openeye Name: 3-[(3-hydroxy-4-methoxy-phenyl)methylammonio]propyl-dimethyl-ammonium CAS Name: 3-[(3-hydroxy-4-methoxyphenyl)methylammonio]propyl-dimethylammonium IUPAC Name: 3-[(3-hydroxy-4-methoxyphenyl)methylazaniumyl]propyl-dimethylazanium Traditional Name: 3-[(3-hydroxy-4-methoxy-benzyl)ammonio]propyl-dimethyl-ammonium Formula: C13H24N2O2+2 MolecularWeight: 240.34186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[NH2+]CC1=CC(=C(C=C1)OC)O

Isomeric SMILES

C[NH+](C)CCC[NH2+]CC1=CC(=C(C=C1)OC)O

InChI

InChI=1S/C13H22N2O2/c1-15(2)8-4-7-14-10-11-5-6-13(17-3)12(16)9-11/h5-6,9,14,16H,4,7-8,10H2,1-3H3/p+2