dimethyl 5-butyl-8-(2-oxidanylethenyl)-4-oxidanylidene-2H-pyrrolo[3,4-c]quinoline-1,3-dicarboxylate

Systemtic Name: dimethyl 5-butyl-8-(2-oxidanylethenyl)-4-oxidanylidene-2H-pyrrolo[3,4-c]quinoline-1,3-dicarboxylate Openeye Name: dimethyl 5-butyl-8-(2-hydroxyvinyl)-4-oxo-2H-pyrrolo[3,4-c]quinoline-1,3-dicarboxylate CAS Name: 5-butyl-8-(2-hydroxyethenyl)-4-oxo-2H-pyrrolo[3,4-c]quinoline-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-butyl-8-(2-hydroxyethenyl)-4-oxo-2H-pyrrolo[3,4-c]quinoline-1,3-dicarboxylate Traditional Name: 5-butyl-8-(2-hydroxyvinyl)-4-keto-2H-pyrrolo[3,4-c]quinoline-1,3-dicarboxylic acid dimethyl ester Formula: C21H22N2O6 MolecularWeight: 398.40918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)C=CO)C3=C(NC(=C3C1=O)C(=O)OC)C(=O)OC

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)C=CO)C3=C(NC(=C3C1=O)C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H22N2O6/c1-4-5-9-23-14-7-6-12(8-10-24)11-13(14)15-16(19(23)25)18(21(27)29-3)22-17(15)20(26)28-2/h6-8,10-11,22,24H,4-5,9H2,1-3H3