[4-(diethylamino)-2-oxidanyl-phenyl]methyl-[2-(3,4-dimethoxyphenyl)ethyl]azanium

Systemtic Name: [4-(diethylamino)-2-oxidanyl-phenyl]methyl-[2-(3,4-dimethoxyphenyl)ethyl]azanium Openeye Name: [4-(diethylamino)-2-hydroxy-phenyl]methyl-[2-(3,4-dimethoxyphenyl)ethyl]ammonium CAS Name: [4-(diethylamino)-2-hydroxyphenyl]methyl-[2-(3,4-dimethoxyphenyl)ethyl]ammonium IUPAC Name: [4-(diethylamino)-2-hydroxyphenyl]methyl-[2-(3,4-dimethoxyphenyl)ethyl]azanium Traditional Name: [4-(diethylamino)-2-hydroxy-benzyl]-homoveratryl-ammonium Formula: C21H31N2O3+ MolecularWeight: 359.48244

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)C[NH2+]CCC2=CC(=C(C=C2)OC)OC)O

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)C[NH2+]CCC2=CC(=C(C=C2)OC)OC)O

InChI

InChI=1S/C21H30N2O3/c1-5-23(6-2)18-9-8-17(19(24)14-18)15-22-12-11-16-7-10-20(25-3)21(13-16)26-4/h7-10,13-14,22,24H,5-6,11-12,15H2,1-4H3/p+1