ethyl 3-[2-(8-methyl-4-oxidanylidene-2H-pyridazino[4,5-b]indol-3-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-(8-methyl-4-oxidanylidene-2H-pyridazino[4,5-b]indol-3-yl)ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-(8-methyl-4-oxo-2H-pyridazino[4,5-b]indol-3-yl)acetyl]amino]benzoate CAS Name: 3-[[2-(8-methyl-4-oxo-2H-pyridazino[4,5-b]indol-3-yl)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(8-methyl-4-oxo-2H-pyridazino[4,5-b]indol-3-yl)acetyl]amino]benzoate Traditional Name: 3-[[2-(4-keto-8-methyl-2H-pyridazin[4,5-b]indol-3-yl)acetyl]amino]benzoic acid ethyl ester Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CN2C(=O)C3=NC4=C(C3=CN2)C=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CN2C(=O)C3=NC4=C(C3=CN2)C=C(C=C4)C

InChI

InChI=1S/C22H20N4O4/c1-3-30-22(29)14-5-4-6-15(10-14)24-19(27)12-26-21(28)20-17(11-23-26)16-9-13(2)7-8-18(16)25-20/h4-11,23H,3,12H2,1-2H3,(H,24,27)