4-(azaniumylmethyl)heptan-4-yl-ethyl-(phenylmethyl)azanium

Systemtic Name: 4-(azaniumylmethyl)heptan-4-yl-ethyl-(phenylmethyl)azanium Openeye Name: [1-(azaniumylmethyl)-1-propyl-butyl]-benzyl-ethyl-ammonium CAS Name: 4-(ammoniomethyl)heptan-4-yl-ethyl-(phenylmethyl)ammonium IUPAC Name: 4-(azaniumylmethyl)heptan-4-yl-benzyl-ethylazanium Traditional Name: [1-(ammoniomethyl)-1-propyl-butyl]-benzyl-ethyl-ammonium Formula: C17H32N2+2 MolecularWeight: 264.44938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H30N2/c1-4-12-17(15-18,13-5-2)19(6-3)14-16-10-8-7-9-11-16/h7-11H,4-6,12-15,18H2,1-3H3/p+2