(3,4-dimethoxyphenyl)methyl-[(2S)-2-(dimethylamino)-3-methyl-butyl]azanium

Systemtic Name: (3,4-dimethoxyphenyl)methyl-[(2S)-2-(dimethylamino)-3-methyl-butyl]azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-[(2S)-2-(dimethylamino)-3-methyl-butyl]ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-[(2S)-2-(dimethylamino)-3-methylbutyl]ammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-[(2S)-2-(dimethylamino)-3-methylbutyl]azanium Traditional Name: [(2S)-2-(dimethylamino)-3-methyl-butyl]-veratryl-ammonium Formula: C16H29N2O2+ MolecularWeight: 281.41366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C[NH2+]CC1=CC(=C(C=C1)OC)OC)N(C)C

Isomeric SMILES

CC(C)[C@@H](C[NH2+]CC1=CC(=C(C=C1)OC)OC)N(C)C

InChI

InChI=1S/C16H28N2O2/c1-12(2)14(18(3)4)11-17-10-13-7-8-15(19-5)16(9-13)20-6/h7-9,12,14,17H,10-11H2,1-6H3/p+1/t14-/m1/s1