2-azaniumylethyl-[(4-tert-butylphenyl)methyl]-prop-2-enyl-azanium

Systemtic Name: 2-azaniumylethyl-[(4-tert-butylphenyl)methyl]-prop-2-enyl-azanium Openeye Name: allyl-(2-azaniumylethyl)-[(4-tert-butylphenyl)methyl]ammonium CAS Name: 2-ammonioethyl-[(4-tert-butylphenyl)methyl]-prop-2-enylammonium IUPAC Name: 2-azaniumylethyl-[(4-tert-butylphenyl)methyl]-prop-2-enylazanium Traditional Name: allyl-(2-ammonioethyl)-(4-tert-butylbenzyl)ammonium Formula: C16H28N2+2 MolecularWeight: 248.40692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2/c1-5-11-18(12-10-17)13-14-6-8-15(9-7-14)16(2,3)4/h5-9H,1,10-13,17H2,2-4H3/p+2