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

Systemtic Name: ethyl 7-chloranyl-3-(3-methoxyphenyl)-5-methyl-4-oxidanylidene-pyridazino[4,5-b]indole-1-carboxylate Openeye Name: ethyl 7-chloro-3-(3-methoxyphenyl)-5-methyl-4-oxo-pyridazino[4,5-b]indole-1-carboxylate CAS Name: 7-chloro-3-(3-methoxyphenyl)-5-methyl-4-oxo-1-pyridazino[4,5-b]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 7-chloro-3-(3-methoxyphenyl)-5-methyl-4-oxopyridazino[4,5-b]indole-1-carboxylate Traditional Name: 7-chloro-4-keto-3-(3-methoxyphenyl)-5-methyl-pyridazin[4,5-b]indole-1-carboxylic acid ethyl ester Formula: C21H18ClN3O4 MolecularWeight: 411.83832

Click to see the large picture

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)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClN3O4/c1-4-29-21(27)18-17-15-9-8-12(22)10-16(15)24(2)19(17)20(26)25(23-18)13-6-5-7-14(11-13)28-3/h5-11H,4H2,1-3H3