methyl-[3-(pentylazaniumyl)propyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[3-(pentylazaniumyl)propyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[3-(pentylammonio)propyl]ammonium CAS Name: methyl-[3-(pentylammonio)propyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[3-(pentylazaniumyl)propyl]azanium Traditional Name: 3-(amylammonio)propyl-benzyl-methyl-ammonium Formula: C16H30N2+2 MolecularWeight: 250.4228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH2+]CCC[NH+](C)CC1=CC=CC=C1

Isomeric SMILES

CCCCC[NH2+]CCC[NH+](C)CC1=CC=CC=C1

InChI

InChI=1S/C16H28N2/c1-3-4-8-12-17-13-9-14-18(2)15-16-10-6-5-7-11-16/h5-7,10-11,17H,3-4,8-9,12-15H2,1-2H3/p+2