2-(3,4-dimethoxyphenyl)ethyl-methyl-[(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-[(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2-hydroxy-5-isopropyl-4-methyl-phenyl)methyl]-methyl-ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2-hydroxy-4-methyl-5-propan-2-ylphenyl)methyl]-methylammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2-hydroxy-4-methyl-5-propan-2-ylphenyl)methyl]-methylazanium Traditional Name: homoveratryl-(2-hydroxy-5-isopropyl-4-methyl-benzyl)-methyl-ammonium Formula: C22H32NO3+ MolecularWeight: 358.49438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(C)C)C[NH+](C)CCC2=CC(=C(C=C2)OC)OC)O

Isomeric SMILES

CC1=CC(=C(C=C1C(C)C)C[NH+](C)CCC2=CC(=C(C=C2)OC)OC)O

InChI

InChI=1S/C22H31NO3/c1-15(2)19-13-18(20(24)11-16(19)3)14-23(4)10-9-17-7-8-21(25-5)22(12-17)26-6/h7-8,11-13,15,24H,9-10,14H2,1-6H3/p+1