[(Z)-4-(2-bromophenyl)-3-methyl-but-2-enyl]-diethyl-(2-heptoxy-2-oxidanylidene-ethyl)azanium

Systemtic Name: [(Z)-4-(2-bromophenyl)-3-methyl-but-2-enyl]-diethyl-(2-heptoxy-2-oxidanylidene-ethyl)azanium Openeye Name: [(Z)-4-(2-bromophenyl)-3-methyl-but-2-enyl]-diethyl-(2-heptoxy-2-oxo-ethyl)ammonium CAS Name: [(Z)-4-(2-bromophenyl)-3-methylbut-2-enyl]-diethyl-(2-heptoxy-2-oxoethyl)ammonium IUPAC Name: [(Z)-4-(2-bromophenyl)-3-methylbut-2-enyl]-diethyl-(2-heptoxy-2-oxoethyl)azanium Traditional Name: [(Z)-4-(2-bromophenyl)-3-methyl-but-2-enyl]-diethyl-(2-heptoxy-2-keto-ethyl)ammonium Formula: C24H39BrNO2+ MolecularWeight: 453.47596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C[N+](CC)(CC)CC=C(C)CC1=CC=CC=C1Br

Isomeric SMILES

CCCCCCCOC(=O)C[N+](CC)(CC)C/C=C(/C)\CC1=CC=CC=C1Br

InChI

InChI=1S/C24H39BrNO2/c1-5-8-9-10-13-18-28-24(27)20-26(6-2,7-3)17-16-21(4)19-22-14-11-12-15-23(22)25/h11-12,14-16H,5-10,13,17-20H2,1-4H3/q+1/b21-16-