3-azaniumylpropyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-azaniumylpropyl-methyl-(phenylmethyl)azanium Openeye Name: 3-azaniumylpropyl-benzyl-methyl-ammonium CAS Name: 3-ammoniopropyl-methyl-(phenylmethyl)ammonium IUPAC Name: 3-azaniumylpropyl-benzyl-methylazanium Traditional Name: 3-ammoniopropyl-benzyl-methyl-ammonium Formula: C11H20N2+2 MolecularWeight: 180.2899

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H18N2/c1-13(9-5-8-12)10-11-6-3-2-4-7-11/h2-4,6-7H,5,8-10,12H2,1H3/p+2