1-(12H-indolo[2,3-a]quinolizin-5-ium-3-yl)ethyl benzoate perchlorate

Systemtic Name: 1-(12H-indolo[2,3-a]quinolizin-5-ium-3-yl)ethyl benzoate perchlorate Openeye Name: 1-(12H-indolo[2,3-a]quinolizin-5-ium-3-yl)ethyl benzoate perchlorate CAS Name: benzoic acid 1-(12H-indolo[2,3-a]quinolizin-5-ium-3-yl)ethyl ester perchlorate IUPAC Name: 1-(12H-indolo[2,3-a]quinolizin-5-ium-3-yl)ethyl benzoate perchlorate Traditional Name: benzoic acid 1-(12H-pyrido[2,1-a]$b-carbolin-5-ium-3-yl)ethyl ester perchlorate Formula: C24H19ClN2O6 MolecularWeight: 466.87046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C[N+]2=C(C=C1)C3=C(C=C2)C4=CC=CC=C4N3)OC(=O)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC(C1=C[N+]2=C(C=C1)C3=C(C=C2)C4=CC=CC=C4N3)OC(=O)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C24H18N2O2.ClHO4/c1-16(28-24(27)17-7-3-2-4-8-17)18-11-12-22-23-20(13-14-26(22)15-18)19-9-5-6-10-21(19)25-23;2-1(3,4)5/h2-16H,1H3;(H,2,3,4,5)