ethyl 1-(1,3-benzodioxol-5-yl)-5-methyl-4-oxidanylidene-1,2-dihydropyridazino[4,5-b]indole-3-carboxylate

Systemtic Name: ethyl 1-(1,3-benzodioxol-5-yl)-5-methyl-4-oxidanylidene-1,2-dihydropyridazino[4,5-b]indole-3-carboxylate Openeye Name: ethyl 1-(1,3-benzodioxol-5-yl)-5-methyl-4-oxo-1,2-dihydropyridazino[4,5-b]indole-3-carboxylate CAS Name: 1-(1,3-benzodioxol-5-yl)-5-methyl-4-oxo-1,2-dihydropyridazino[4,5-b]indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(1,3-benzodioxol-5-yl)-5-methyl-4-oxo-1,2-dihydropyridazino[4,5-b]indole-3-carboxylate Traditional Name: 1-(1,3-benzodioxol-5-yl)-4-keto-5-methyl-1,2-dihydropyridazin[4,5-b]indole-3-carboxylic acid ethyl ester Formula: C21H19N3O5 MolecularWeight: 393.39266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(=O)C2=C(C(N1)C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5N2C

Isomeric SMILES

CCOC(=O)N1C(=O)C2=C(C(N1)C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5N2C

InChI

InChI=1S/C21H19N3O5/c1-3-27-21(26)24-20(25)19-17(13-6-4-5-7-14(13)23(19)2)18(22-24)12-8-9-15-16(10-12)29-11-28-15/h4-10,18,22H,3,11H2,1-2H3