4-azaniumylbutyl-ethyl-(phenylmethyl)azanium

Systemtic Name: 4-azaniumylbutyl-ethyl-(phenylmethyl)azanium Openeye Name: 4-azaniumylbutyl-benzyl-ethyl-ammonium CAS Name: 4-ammoniobutyl-ethyl-(phenylmethyl)ammonium IUPAC Name: 4-azaniumylbutyl-benzyl-ethylazanium Traditional Name: 4-ammoniobutyl-benzyl-ethyl-ammonium Formula: C13H24N2+2 MolecularWeight: 208.34306

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCCC[NH3+])CC1=CC=CC=C1

Isomeric SMILES

CC[NH+](CCCC[NH3+])CC1=CC=CC=C1

InChI

InChI=1S/C13H22N2/c1-2-15(11-7-6-10-14)12-13-8-4-3-5-9-13/h3-5,8-9H,2,6-7,10-12,14H2,1H3/p+2