[(1S)-2-azaniumyl-1-(3-hydroxyphenyl)ethyl]-bis(2-methylpropyl)azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(3-hydroxyphenyl)ethyl]-bis(2-methylpropyl)azanium Openeye Name: [(1S)-2-azaniumyl-1-(3-hydroxyphenyl)ethyl]-diisobutyl-ammonium CAS Name: [(1S)-2-ammonio-1-(3-hydroxyphenyl)ethyl]-bis(2-methylpropyl)ammonium IUPAC Name: [(1S)-2-azaniumyl-1-(3-hydroxyphenyl)ethyl]-bis(2-methylpropyl)azanium Traditional Name: [(1S)-2-ammonio-1-(3-hydroxyphenyl)ethyl]-diisobutyl-ammonium Formula: C16H30N2O+2 MolecularWeight: 266.4222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N2O/c1-12(2)10-18(11-13(3)4)16(9-17)14-6-5-7-15(19)8-14/h5-8,12-13,16,19H,9-11,17H2,1-4H3/p+2/t16-/m1/s1