[(2S)-2-(dimethylamino)-3-methyl-butyl]-[(4-ethoxy-3-methoxy-phenyl)methyl]azanium

Systemtic Name: [(2S)-2-(dimethylamino)-3-methyl-butyl]-[(4-ethoxy-3-methoxy-phenyl)methyl]azanium Openeye Name: [(2S)-2-(dimethylamino)-3-methyl-butyl]-[(4-ethoxy-3-methoxy-phenyl)methyl]ammonium CAS Name: [(2S)-2-(dimethylamino)-3-methylbutyl]-[(4-ethoxy-3-methoxyphenyl)methyl]ammonium IUPAC Name: [(2S)-2-(dimethylamino)-3-methylbutyl]-[(4-ethoxy-3-methoxyphenyl)methyl]azanium Traditional Name: [(2S)-2-(dimethylamino)-3-methyl-butyl]-(4-ethoxy-3-methoxy-benzyl)ammonium Formula: C17H31N2O2+ MolecularWeight: 295.44024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH2+]CC(C(C)C)N(C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH2+]C[C@H](C(C)C)N(C)C)OC

InChI

InChI=1S/C17H30N2O2/c1-7-21-16-9-8-14(10-17(16)20-6)11-18-12-15(13(2)3)19(4)5/h8-10,13,15,18H,7,11-12H2,1-6H3/p+1/t15-/m1/s1