[(1S)-1-(3,4-dimethoxyphenyl)propyl]-(3-methylbutyl)azanium

Systemtic Name: [(1S)-1-(3,4-dimethoxyphenyl)propyl]-(3-methylbutyl)azanium Openeye Name: [(1S)-1-(3,4-dimethoxyphenyl)propyl]-isopentyl-ammonium CAS Name: [(1S)-1-(3,4-dimethoxyphenyl)propyl]-(3-methylbutyl)ammonium IUPAC Name: [(1S)-1-(3,4-dimethoxyphenyl)propyl]-(3-methylbutyl)azanium Traditional Name: [(1S)-1-(3,4-dimethoxyphenyl)propyl]-isoamyl-ammonium Formula: C16H28NO2+ MolecularWeight: 266.39902

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=C(C=C1)OC)OC)[NH2+]CCC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C16H27NO2/c1-6-14(17-10-9-12(2)3)13-7-8-15(18-4)16(11-13)19-5/h7-8,11-12,14,17H,6,9-10H2,1-5H3/p+1/t14-/m0/s1