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

Systemtic Name: [(1S)-2-azaniumyl-1-(3-phenoxyphenyl)ethyl]-butyl-ethyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(3-phenoxyphenyl)ethyl]-butyl-ethyl-ammonium CAS Name: [(1S)-2-ammonio-1-(3-phenoxyphenyl)ethyl]-butyl-ethylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(3-phenoxyphenyl)ethyl]-butyl-ethylazanium Traditional Name: [(1S)-2-ammonio-1-(3-phenoxyphenyl)ethyl]-butyl-ethyl-ammonium Formula: C20H30N2O+2 MolecularWeight: 314.465

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC)C(C[NH3+])C1=CC(=CC=C1)OC2=CC=CC=C2

Isomeric SMILES

CCCC[NH+](CC)[C@H](C[NH3+])C1=CC(=CC=C1)OC2=CC=CC=C2

InChI

InChI=1S/C20H28N2O/c1-3-5-14-22(4-2)20(16-21)17-10-9-13-19(15-17)23-18-11-7-6-8-12-18/h6-13,15,20H,3-5,14,16,21H2,1-2H3/p+2/t20-/m1/s1