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

Systemtic Name: [(1S)-2-azaniumyl-1-(3-methylphenyl)ethyl]-butyl-ethyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(m-tolyl)ethyl]-butyl-ethyl-ammonium CAS Name: [(1S)-2-ammonio-1-(3-methylphenyl)ethyl]-butyl-ethylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(3-methylphenyl)ethyl]-butyl-ethylazanium Traditional Name: [(1S)-2-ammonio-1-(m-tolyl)ethyl]-butyl-ethyl-ammonium Formula: C15H28N2+2 MolecularWeight: 236.39622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H26N2/c1-4-6-10-17(5-2)15(12-16)14-9-7-8-13(3)11-14/h7-9,11,15H,4-6,10,12,16H2,1-3H3/p+2/t15-/m1/s1