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

Systemtic Name: [(1S)-2-azaniumyl-1-(2-propoxyphenyl)ethyl]-butyl-methyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(2-propoxyphenyl)ethyl]-butyl-methyl-ammonium CAS Name: [(1S)-2-ammonio-1-(2-propoxyphenyl)ethyl]-butyl-methylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(2-propoxyphenyl)ethyl]-butyl-methylazanium Traditional Name: [(1S)-2-ammonio-1-(2-propoxyphenyl)ethyl]-butyl-methyl-ammonium Formula: C16H30N2O+2 MolecularWeight: 266.4222

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)C(C[NH3+])C1=CC=CC=C1OCCC

Isomeric SMILES

CCCC[NH+](C)[C@H](C[NH3+])C1=CC=CC=C1OCCC

InChI

InChI=1S/C16H28N2O/c1-4-6-11-18(3)15(13-17)14-9-7-8-10-16(14)19-12-5-2/h7-10,15H,4-6,11-13,17H2,1-3H3/p+2/t15-/m1/s1