3-[[(2S)-4-methoxy-4-methyl-pentan-2-yl]azaniumyl]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[[(2S)-4-methoxy-4-methyl-pentan-2-yl]azaniumyl]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[[(1S)-3-methoxy-1,3-dimethyl-butyl]ammonio]propyl]-methyl-ammonium CAS Name: 3-[[(2S)-4-methoxy-4-methylpentan-2-yl]ammonio]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[[(2S)-4-methoxy-4-methylpentan-2-yl]azaniumyl]propyl]-methylazanium Traditional Name: benzyl-[3-[[(1S)-3-methoxy-1,3-dimethyl-butyl]ammonio]propyl]-methyl-ammonium Formula: C18H34N2O+2 MolecularWeight: 294.47536

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)(C)OC)[NH2+]CCC[NH+](C)CC1=CC=CC=C1

Isomeric SMILES

C[C@@H](CC(C)(C)OC)[NH2+]CCC[NH+](C)CC1=CC=CC=C1

InChI

InChI=1S/C18H32N2O/c1-16(14-18(2,3)21-5)19-12-9-13-20(4)15-17-10-7-6-8-11-17/h6-8,10-11,16,19H,9,12-15H2,1-5H3/p+2/t16-/m0/s1