N-(1-cyano-9,10-dimethoxy-6,7-dihydro-2H-benzo[a]quinolizin-4-yl)-3-iodanyl-benzamide

Systemtic Name: N-(1-cyano-9,10-dimethoxy-6,7-dihydro-2H-benzo[a]quinolizin-4-yl)-3-iodanyl-benzamide Openeye Name: N-(1-cyano-9,10-dimethoxy-6,7-dihydro-2H-benzo[a]quinolizin-4-yl)-3-iodo-benzamide CAS Name: N-(1-cyano-9,10-dimethoxy-6,7-dihydro-2H-benzo[a]quinolizin-4-yl)-3-iodobenzamide IUPAC Name: N-(1-cyano-9,10-dimethoxy-6,7-dihydro-2H-benzo[a]quinolizin-4-yl)-3-iodobenzamide Traditional Name: N-(1-cyano-9,10-dimethoxy-6,7-dihydro-2H-benzo[a]quinolizin-4-yl)-3-iodo-benzamide Formula: C23H20IN3O3 MolecularWeight: 513.32767

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN3C2=C(CC=C3NC(=O)C4=CC(=CC=C4)I)C#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN3C2=C(CC=C3NC(=O)C4=CC(=CC=C4)I)C#N)OC

InChI

InChI=1S/C23H20IN3O3/c1-29-19-11-14-8-9-27-21(26-23(28)15-4-3-5-17(24)10-15)7-6-16(13-25)22(27)18(14)12-20(19)30-2/h3-5,7,10-12H,6,8-9H2,1-2H3,(H,26,28)