(9,10-dimethoxy-4-oxidanylidene-1,6,7,11b-tetrahydrobenzo[a]quinolizin-2-yl) 2-bromanyl-5-methoxy-benzoate

Systemtic Name: (9,10-dimethoxy-4-oxidanylidene-1,6,7,11b-tetrahydrobenzo[a]quinolizin-2-yl) 2-bromanyl-5-methoxy-benzoate Openeye Name: (9,10-dimethoxy-4-oxo-1,6,7,11b-tetrahydrobenzo[a]quinolizin-2-yl) 2-bromo-5-methoxy-benzoate CAS Name: 2-bromo-5-methoxybenzoic acid (9,10-dimethoxy-4-oxo-1,6,7,11b-tetrahydrobenzo[a]quinolizin-2-yl) ester IUPAC Name: (9,10-dimethoxy-4-oxo-1,6,7,11b-tetrahydrobenzo[a]quinolizin-2-yl) 2-bromo-5-methoxybenzoate Traditional Name: 2-bromo-5-methoxy-benzoic acid (4-keto-9,10-dimethoxy-1,6,7,11b-tetrahydrobenzo[a]quinolizin-2-yl) ester Formula: C23H22BrNO6 MolecularWeight: 488.32788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)OC2=CC(=O)N3CCC4=CC(=C(C=C4C3C2)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)OC2=CC(=O)N3CCC4=CC(=C(C=C4C3C2)OC)OC

InChI

InChI=1S/C23H22BrNO6/c1-28-14-4-5-18(24)17(9-14)23(27)31-15-10-19-16-12-21(30-3)20(29-2)8-13(16)6-7-25(19)22(26)11-15/h4-5,8-9,11-12,19H,6-7,10H2,1-3H3