ethyl 7-chloranyl-5-methyl-4-oxidanylidene-3-phenyl-pyridazino[4,5-b]indole-1-carboxylate

Systemtic Name: ethyl 7-chloranyl-5-methyl-4-oxidanylidene-3-phenyl-pyridazino[4,5-b]indole-1-carboxylate Openeye Name: ethyl 7-chloro-5-methyl-4-oxo-3-phenyl-pyridazino[4,5-b]indole-1-carboxylate CAS Name: 7-chloro-5-methyl-4-oxo-3-phenyl-1-pyridazino[4,5-b]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 7-chloro-5-methyl-4-oxo-3-phenylpyridazino[4,5-b]indole-1-carboxylate Traditional Name: 7-chloro-4-keto-5-methyl-3-phenyl-pyridazin[4,5-b]indole-1-carboxylic acid ethyl ester Formula: C20H16ClN3O3 MolecularWeight: 381.81234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C2=C1C3=C(N2C)C=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C2=C1C3=C(N2C)C=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H16ClN3O3/c1-3-27-20(26)17-16-14-10-9-12(21)11-15(14)23(2)18(16)19(25)24(22-17)13-7-5-4-6-8-13/h4-11H,3H2,1-2H3