[(2R)-1-azaniumyl-3-ethyl-pentan-2-yl]-ethyl-(phenylmethyl)azanium

Systemtic Name: [(2R)-1-azaniumyl-3-ethyl-pentan-2-yl]-ethyl-(phenylmethyl)azanium Openeye Name: [(1R)-1-(azaniumylmethyl)-2-ethyl-butyl]-benzyl-ethyl-ammonium CAS Name: [(2R)-1-ammonio-3-ethylpentan-2-yl]-ethyl-(phenylmethyl)ammonium IUPAC Name: [(2R)-1-azaniumyl-3-ethylpentan-2-yl]-benzyl-ethylazanium Traditional Name: [(1R)-1-(ammoniomethyl)-2-ethyl-butyl]-benzyl-ethyl-ammonium Formula: C16H30N2+2 MolecularWeight: 250.4228

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(C[NH3+])[NH+](CC)CC1=CC=CC=C1

Isomeric SMILES

CCC(CC)[C@H](C[NH3+])[NH+](CC)CC1=CC=CC=C1

InChI

InChI=1S/C16H28N2/c1-4-15(5-2)16(12-17)18(6-3)13-14-10-8-7-9-11-14/h7-11,15-16H,4-6,12-13,17H2,1-3H3/p+2/t16-/m0/s1