dimethyl 9-bromanyl-5-methylsulfonyl-11-oxidanylidene-benzo[b]carbazole-6,6-dicarboxylate

Systemtic Name: dimethyl 9-bromanyl-5-methylsulfonyl-11-oxidanylidene-benzo[b]carbazole-6,6-dicarboxylate Openeye Name: dimethyl 9-bromo-5-methylsulfonyl-11-oxo-benzo[b]carbazole-6,6-dicarboxylate CAS Name: 9-bromo-5-methylsulfonyl-11-oxobenzo[b]carbazole-6,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 9-bromo-5-methylsulfonyl-11-oxobenzo[b]carbazole-6,6-dicarboxylate Traditional Name: 9-bromo-11-keto-5-mesyl-benzo[b]carbazole-6,6-dicarboxylic acid dimethyl ester Formula: C21H16BrNO7S MolecularWeight: 506.32324

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C2=C(C=C(C=C2)Br)C(=O)C3=C1N(C4=CC=CC=C43)S(=O)(=O)C)C(=O)OC

Isomeric SMILES

COC(=O)C1(C2=C(C=C(C=C2)Br)C(=O)C3=C1N(C4=CC=CC=C43)S(=O)(=O)C)C(=O)OC

InChI

InChI=1S/C21H16BrNO7S/c1-29-19(25)21(20(26)30-2)14-9-8-11(22)10-13(14)17(24)16-12-6-4-5-7-15(12)23(18(16)21)31(3,27)28/h4-10H,1-3H3