4-azanyl-2-(1,3-benzodioxol-5-yl)-9,10-dimethoxy-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile

Systemtic Name: 4-azanyl-2-(1,3-benzodioxol-5-yl)-9,10-dimethoxy-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile Openeye Name: 4-amino-2-(1,3-benzodioxol-5-yl)-9,10-dimethoxy-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile CAS Name: 4-amino-2-(1,3-benzodioxol-5-yl)-9,10-dimethoxy-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile IUPAC Name: 4-amino-2-(1,3-benzodioxol-5-yl)-9,10-dimethoxy-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile Traditional Name: 4-amino-2-(1,3-benzodioxol-5-yl)-9,10-dimethoxy-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile Formula: C23H20N3O4+ MolecularWeight: 402.4226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC[N+]3=C2C=C(C(=C3N)C#N)C4=CC5=C(C=C4)OCO5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC[N+]3=C2C=C(C(=C3N)C#N)C4=CC5=C(C=C4)OCO5)OC

InChI

InChI=1S/C23H19N3O4/c1-27-20-7-14-5-6-26-18(16(14)10-21(20)28-2)9-15(17(11-24)23(26)25)13-3-4-19-22(8-13)30-12-29-19/h3-4,7-10,25H,5-6,12H2,1-2H3/p+1