[(2S)-1-azaniumyl-4-phenyl-butan-2-yl]-bis(2-methylpropyl)azanium

Systemtic Name: [(2S)-1-azaniumyl-4-phenyl-butan-2-yl]-bis(2-methylpropyl)azanium Openeye Name: [(1S)-1-(azaniumylmethyl)-3-phenyl-propyl]-diisobutyl-ammonium CAS Name: [(2S)-1-ammonio-4-phenylbutan-2-yl]-bis(2-methylpropyl)ammonium IUPAC Name: [(2S)-1-azaniumyl-4-phenylbutan-2-yl]-bis(2-methylpropyl)azanium Traditional Name: [(1S)-1-(ammoniomethyl)-3-phenyl-propyl]-diisobutyl-ammonium Formula: C18H34N2+2 MolecularWeight: 278.47596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+](CC(C)C)C(CCC1=CC=CC=C1)C[NH3+]

Isomeric SMILES

CC(C)C[NH+](CC(C)C)[C@@H](CCC1=CC=CC=C1)C[NH3+]

InChI

InChI=1S/C18H32N2/c1-15(2)13-20(14-16(3)4)18(12-19)11-10-17-8-6-5-7-9-17/h5-9,15-16,18H,10-14,19H2,1-4H3/p+2/t18-/m0/s1