1,2-bis(ethenyl)benzene; trihexyl(1-phenylprop-2-enyl)azanium; chloride

Systemtic Name: 1,2-bis(ethenyl)benzene; trihexyl(1-phenylprop-2-enyl)azanium; chloride Openeye Name: 1,2-divinylbenzene; trihexyl(1-phenylallyl)ammonium; chloride CAS Name: 1,2-bis(ethenyl)benzene; trihexyl(1-phenylprop-2-enyl)ammonium; chloride IUPAC Name: 1,2-bis(ethenyl)benzene; trihexyl(1-phenylprop-2-enyl)azanium; chloride Traditional Name: 1,2-divinylbenzene; trihexyl(1-phenylallyl)ammonium; chloride Formula: C37H58ClN MolecularWeight: 552.31612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+](CCCCCC)(CCCCCC)C(C=C)C1=CC=CC=C1.C=CC1=CC=CC=C1C=C.[Cl-]

Isomeric SMILES

CCCCCC[N+](CCCCCC)(CCCCCC)C(C=C)C1=CC=CC=C1.C=CC1=CC=CC=C1C=C.[Cl-]

InChI

InChI=1S/C27H48N.C10H10.ClH/c1-5-9-12-18-23-28(24-19-13-10-6-2,25-20-14-11-7-3)27(8-4)26-21-16-15-17-22-26;1-3-9-7-5-6-8-10(9)4-2;/h8,15-17,21-22,27H,4-7,9-14,18-20,23-25H2,1-3H3;3-8H,1-2H2;1H/q+1;;/p-1