3-(azaniumylmethyl)pentan-3-yl-methyl-[(4-methylphenyl)methyl]azanium

Systemtic Name: 3-(azaniumylmethyl)pentan-3-yl-methyl-[(4-methylphenyl)methyl]azanium Openeye Name: [1-(azaniumylmethyl)-1-ethyl-propyl]-methyl-(p-tolylmethyl)ammonium CAS Name: 3-(ammoniomethyl)pentan-3-yl-methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: 3-(azaniumylmethyl)pentan-3-yl-methyl-[(4-methylphenyl)methyl]azanium Traditional Name: [1-(ammoniomethyl)-1-ethyl-propyl]-methyl-(4-methylbenzyl)ammonium Formula: C15H28N2+2 MolecularWeight: 236.39622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H26N2/c1-5-15(6-2,12-16)17(4)11-14-9-7-13(3)8-10-14/h7-10H,5-6,11-12,16H2,1-4H3/p+2