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

Systemtic Name: 4-azanyl-9,10-dimethoxy-2-(3-methylthiophen-2-yl)-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile Openeye Name: 4-amino-9,10-dimethoxy-2-(3-methyl-2-thienyl)-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile CAS Name: 4-amino-9,10-dimethoxy-2-(3-methyl-2-thiophenyl)-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile IUPAC Name: 4-amino-9,10-dimethoxy-2-(3-methylthiophen-2-yl)-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile Traditional Name: 4-amino-9,10-dimethoxy-2-(3-methyl-2-thienyl)-6,7-dihydrobenzo[a]quinolizin-5-ium-3-carbonitrile Formula: C21H20N3O2S+ MolecularWeight: 378.4674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2=CC3=[N+](CCC4=CC(=C(C=C43)OC)OC)C(=C2C#N)N

Isomeric SMILES

CC1=C(SC=C1)C2=CC3=[N+](CCC4=CC(=C(C=C43)OC)OC)C(=C2C#N)N

InChI

InChI=1S/C21H19N3O2S/c1-12-5-7-27-20(12)15-9-17-14-10-19(26-3)18(25-2)8-13(14)4-6-24(17)21(23)16(15)11-22/h5,7-10,23H,4,6H2,1-3H3/p+1