[(1S)-2-azaniumyl-1-(3-ethoxyphenyl)ethyl]-butyl-methyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(3-ethoxyphenyl)ethyl]-butyl-methyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(3-ethoxyphenyl)ethyl]-butyl-methyl-ammonium CAS Name: [(1S)-2-ammonio-1-(3-ethoxyphenyl)ethyl]-butyl-methylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(3-ethoxyphenyl)ethyl]-butyl-methylazanium Traditional Name: [(1S)-2-ammonio-1-m-phenetyl-ethyl]-butyl-methyl-ammonium Formula: C15H28N2O+2 MolecularWeight: 252.39562

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)C(C[NH3+])C1=CC(=CC=C1)OCC

Isomeric SMILES

CCCC[NH+](C)[C@H](C[NH3+])C1=CC(=CC=C1)OCC

InChI

InChI=1S/C15H26N2O/c1-4-6-10-17(3)15(12-16)13-8-7-9-14(11-13)18-5-2/h7-9,11,15H,4-6,10,12,16H2,1-3H3/p+2/t15-/m1/s1