ethyl 8-(3-methylsulfonylphenyl)-4-oxidanylidene-3,5-dihydropyrrolo[2,3-c]quinoline-1-carboxylate

Systemtic Name: ethyl 8-(3-methylsulfonylphenyl)-4-oxidanylidene-3,5-dihydropyrrolo[2,3-c]quinoline-1-carboxylate Openeye Name: ethyl 8-(3-methylsulfonylphenyl)-4-oxo-3,5-dihydropyrrolo[2,3-c]quinoline-1-carboxylate CAS Name: 8-(3-methylsulfonylphenyl)-4-oxo-3,5-dihydropyrrolo[2,3-c]quinoline-1-carboxylic acid ethyl ester IUPAC Name: ethyl 8-(3-methylsulfonylphenyl)-4-oxo-3,5-dihydropyrrolo[2,3-c]quinoline-1-carboxylate Traditional Name: 4-keto-8-(3-mesylphenyl)-3,5-dihydropyrrolo[2,3-c]quinoline-1-carboxylic acid ethyl ester Formula: C21H18N2O5S MolecularWeight: 410.44302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C1C3=C(C=CC(=C3)C4=CC(=CC=C4)S(=O)(=O)C)NC2=O

Isomeric SMILES

CCOC(=O)C1=CNC2=C1C3=C(C=CC(=C3)C4=CC(=CC=C4)S(=O)(=O)C)NC2=O

InChI

InChI=1S/C21H18N2O5S/c1-3-28-21(25)16-11-22-19-18(16)15-10-13(7-8-17(15)23-20(19)24)12-5-4-6-14(9-12)29(2,26)27/h4-11,22H,3H2,1-2H3,(H,23,24)