(3-ethenylphenyl)methyl-diethyl-(4-sulfobutyl)azanium

Systemtic Name: (3-ethenylphenyl)methyl-diethyl-(4-sulfobutyl)azanium Openeye Name: diethyl-(4-sulfobutyl)-[(3-vinylphenyl)methyl]ammonium CAS Name: (3-ethenylphenyl)methyl-diethyl-(4-sulfobutyl)ammonium IUPAC Name: (3-ethenylphenyl)methyl-diethyl-(4-sulfobutyl)azanium Traditional Name: diethyl-(4-sulfobutyl)-(3-vinylbenzyl)ammonium Formula: C17H28NO3S+ MolecularWeight: 326.47412

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CCCCS(=O)(=O)O)CC1=CC=CC(=C1)C=C

Isomeric SMILES

CC[N+](CC)(CCCCS(=O)(=O)O)CC1=CC=CC(=C1)C=C

InChI

InChI=1S/C17H27NO3S/c1-4-16-10-9-11-17(14-16)15-18(5-2,6-3)12-7-8-13-22(19,20)21/h4,9-11,14H,1,5-8,12-13,15H2,2-3H3/p+1