(7S,11bR)-7-phenyl-7-prop-2-enyl-2,3,4,11b-tetrahydro-1H-benzo[a]quinolizin-5-ium bromide

Systemtic Name: (7S,11bR)-7-phenyl-7-prop-2-enyl-2,3,4,11b-tetrahydro-1H-benzo[a]quinolizin-5-ium bromide Openeye Name: (7S,11bR)-7-allyl-7-phenyl-2,3,4,11b-tetrahydro-1H-benzo[a]quinolizin-5-ium bromide CAS Name: (7S,11bR)-7-phenyl-7-prop-2-enyl-2,3,4,11b-tetrahydro-1H-benzo[a]quinolizin-5-ium bromide IUPAC Name: (7S,11bR)-7-phenyl-7-prop-2-enyl-2,3,4,11b-tetrahydro-1H-benzo[a]quinolizin-5-ium bromide Traditional Name: (7S,11bR)-7-allyl-7-phenyl-2,3,4,11b-tetrahydro-1H-benzo[a]quinolizin-5-ium bromide Formula: C22H24BrN MolecularWeight: 382.33666

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1(C=[N+]2CCCCC2C3=CC=CC=C31)C4=CC=CC=C4.[Br-]

Isomeric SMILES

C=CC[C@]1(C=[N+]2CCCC[C@@H]2C3=CC=CC=C31)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C22H24N.BrH/c1-2-15-22(18-10-4-3-5-11-18)17-23-16-9-8-14-21(23)19-12-6-7-13-20(19)22;/h2-7,10-13,17,21H,1,8-9,14-16H2;1H/q+1;/p-1/t21-,22+;/m1./s1