[(2S)-2-(dimethylamino)-4-methyl-pentyl]-[(4-methoxy-3-oxidanyl-phenyl)methyl]azanium

Systemtic Name: [(2S)-2-(dimethylamino)-4-methyl-pentyl]-[(4-methoxy-3-oxidanyl-phenyl)methyl]azanium Openeye Name: [(2S)-2-(dimethylamino)-4-methyl-pentyl]-[(3-hydroxy-4-methoxy-phenyl)methyl]ammonium CAS Name: [(2S)-2-(dimethylamino)-4-methylpentyl]-[(3-hydroxy-4-methoxyphenyl)methyl]ammonium IUPAC Name: [(2S)-2-(dimethylamino)-4-methylpentyl]-[(3-hydroxy-4-methoxyphenyl)methyl]azanium Traditional Name: [(2S)-2-(dimethylamino)-4-methyl-pentyl]-(3-hydroxy-4-methoxy-benzyl)ammonium Formula: C16H29N2O2+ MolecularWeight: 281.41366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N2O2/c1-12(2)8-14(18(3)4)11-17-10-13-6-7-16(20-5)15(19)9-13/h6-7,9,12,14,17,19H,8,10-11H2,1-5H3/p+1/t14-/m0/s1