3-azanylpropyl-[(4-butan-2-ylphenyl)methyl]-dimethyl-azanium

Systemtic Name: 3-azanylpropyl-[(4-butan-2-ylphenyl)methyl]-dimethyl-azanium Openeye Name: 3-aminopropyl-dimethyl-[(4-sec-butylphenyl)methyl]ammonium CAS Name: 3-aminopropyl-[(4-butan-2-ylphenyl)methyl]-dimethylammonium IUPAC Name: 3-aminopropyl-[(4-butan-2-ylphenyl)methyl]-dimethylazanium Traditional Name: 3-aminopropyl-dimethyl-(4-sec-butylbenzyl)ammonium Formula: C16H29N2+ MolecularWeight: 249.41486

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C[N+](C)(C)CCCN

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C[N+](C)(C)CCCN

InChI

InChI=1S/C16H29N2/c1-5-14(2)16-9-7-15(8-10-16)13-18(3,4)12-6-11-17/h7-10,14H,5-6,11-13,17H2,1-4H3/q+1