4-azanyl-9,10-dimethoxy-2-(4-methoxy-3-oxidanyl-phenyl)-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile

Systemtic Name: 4-azanyl-9,10-dimethoxy-2-(4-methoxy-3-oxidanyl-phenyl)-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile Openeye Name: 4-amino-2-(3-hydroxy-4-methoxy-phenyl)-9,10-dimethoxy-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile CAS Name: 4-amino-2-(3-hydroxy-4-methoxyphenyl)-9,10-dimethoxy-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile IUPAC Name: 4-amino-2-(3-hydroxy-4-methoxyphenyl)-9,10-dimethoxy-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile Traditional Name: 4-amino-2-(3-hydroxy-4-methoxy-phenyl)-9,10-dimethoxy-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile Formula: C23H22N3O4+ MolecularWeight: 404.43848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC3=[N+](CCC4=CC(=C(C=C43)OC)OC)C(=C2C#N)N)O

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC3=[N+](CCC4=CC(=C(C=C43)OC)OC)C(=C2C#N)N)O

InChI

InChI=1S/C23H21N3O4/c1-28-20-5-4-13(8-19(20)27)15-10-18-16-11-22(30-3)21(29-2)9-14(16)6-7-26(18)23(25)17(15)12-24/h4-5,8-11,25,27H,6-7H2,1-3H3/p+1