[2-[(heptan-4-ylazaniumyl)methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [2-[(heptan-4-ylazaniumyl)methyl]phenyl]methyl-dimethyl-azanium Openeye Name: dimethyl-[[2-[(1-propylbutylammonio)methyl]phenyl]methyl]ammonium CAS Name: [2-[(heptan-4-ylammonio)methyl]phenyl]methyl-dimethylammonium IUPAC Name: [2-[(heptan-4-ylazaniumyl)methyl]phenyl]methyl-dimethylazanium Traditional Name: dimethyl-[2-[(1-propylbutylammonio)methyl]benzyl]ammonium Formula: C17H32N2+2 MolecularWeight: 264.44938

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)[NH2+]CC1=CC=CC=C1C[NH+](C)C

Isomeric SMILES

CCCC(CCC)[NH2+]CC1=CC=CC=C1C[NH+](C)C

InChI

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