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

Systemtic Name: [(2S)-2-(dimethylamino)-3-methyl-butyl]-[(4-propoxyphenyl)methyl]azanium Openeye Name: [(2S)-2-(dimethylamino)-3-methyl-butyl]-[(4-propoxyphenyl)methyl]ammonium CAS Name: [(2S)-2-(dimethylamino)-3-methylbutyl]-[(4-propoxyphenyl)methyl]ammonium IUPAC Name: [(2S)-2-(dimethylamino)-3-methylbutyl]-[(4-propoxyphenyl)methyl]azanium Traditional Name: [(2S)-2-(dimethylamino)-3-methyl-butyl]-(4-propoxybenzyl)ammonium Formula: C17H31N2O+ MolecularWeight: 279.44084

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C[NH2+]CC(C(C)C)N(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C[NH2+]C[C@H](C(C)C)N(C)C

InChI

InChI=1S/C17H30N2O/c1-6-11-20-16-9-7-15(8-10-16)12-18-13-17(14(2)3)19(4)5/h7-10,14,17-18H,6,11-13H2,1-5H3/p+1/t17-/m1/s1