dimethyl 5-(phenylcarbonyl)pyridazino[4,5-b]indole-1,4-dicarboxylate

Systemtic Name: dimethyl 5-(phenylcarbonyl)pyridazino[4,5-b]indole-1,4-dicarboxylate Openeye Name: dimethyl 5-benzoylpyridazino[4,5-b]indole-1,4-dicarboxylate CAS Name: 5-benzoylpyridazino[4,5-b]indole-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-benzoylpyridazino[4,5-b]indole-1,4-dicarboxylate Traditional Name: 5-benzoylpyridazin[4,5-b]indole-1,4-dicarboxylic acid dimethyl ester Formula: C21H15N3O5 MolecularWeight: 389.3609

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN=C(C2=C1C3=CC=CC=C3N2C(=O)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

COC(=O)C1=NN=C(C2=C1C3=CC=CC=C3N2C(=O)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C21H15N3O5/c1-28-20(26)16-15-13-10-6-7-11-14(13)24(19(25)12-8-4-3-5-9-12)18(15)17(23-22-16)21(27)29-2/h3-11H,1-2H3