ethyl 8-fluoranyl-5-(methoxymethyl)-4-oxidanylidene-3-phenyl-pyridazino[4,5-b]indole-1-carboxylate

Systemtic Name: ethyl 8-fluoranyl-5-(methoxymethyl)-4-oxidanylidene-3-phenyl-pyridazino[4,5-b]indole-1-carboxylate Openeye Name: ethyl 8-fluoro-5-(methoxymethyl)-4-oxo-3-phenyl-pyridazino[4,5-b]indole-1-carboxylate CAS Name: 8-fluoro-5-(methoxymethyl)-4-oxo-3-phenyl-1-pyridazino[4,5-b]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 8-fluoro-5-(methoxymethyl)-4-oxo-3-phenylpyridazino[4,5-b]indole-1-carboxylate Traditional Name: 8-fluoro-4-keto-5-(methoxymethyl)-3-phenyl-pyridazin[4,5-b]indole-1-carboxylic acid ethyl ester Formula: C21H18FN3O4 MolecularWeight: 395.383723

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C2=C1C3=C(N2COC)C=CC(=C3)F)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C2=C1C3=C(N2COC)C=CC(=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C21H18FN3O4/c1-3-29-21(27)18-17-15-11-13(22)9-10-16(15)24(12-28-2)19(17)20(26)25(23-18)14-7-5-4-6-8-14/h4-11H,3,12H2,1-2H3