3-(azaniumylmethyl)pentan-3-yl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-(azaniumylmethyl)pentan-3-yl-methyl-(phenylmethyl)azanium Openeye Name: [1-(azaniumylmethyl)-1-ethyl-propyl]-benzyl-methyl-ammonium CAS Name: 3-(ammoniomethyl)pentan-3-yl-methyl-(phenylmethyl)ammonium IUPAC Name: 3-(azaniumylmethyl)pentan-3-yl-benzyl-methylazanium Traditional Name: [1-(ammoniomethyl)-1-ethyl-propyl]-benzyl-methyl-ammonium Formula: C14H26N2+2 MolecularWeight: 222.36964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H24N2/c1-4-14(5-2,12-15)16(3)11-13-9-7-6-8-10-13/h6-10H,4-5,11-12,15H2,1-3H3/p+2