ethyl 8-iodanyl-1-methyl-6-(morpholin-4-ylmethyl)-4-oxidanylidene-cinnoline-3-carboxylate

Systemtic Name: ethyl 8-iodanyl-1-methyl-6-(morpholin-4-ylmethyl)-4-oxidanylidene-cinnoline-3-carboxylate Openeye Name: ethyl 8-iodo-1-methyl-6-(morpholinomethyl)-4-oxo-cinnoline-3-carboxylate CAS Name: 8-iodo-1-methyl-6-(4-morpholinylmethyl)-4-oxo-3-cinnolinecarboxylic acid ethyl ester IUPAC Name: ethyl 8-iodo-1-methyl-6-(morpholin-4-ylmethyl)-4-oxocinnoline-3-carboxylate Traditional Name: 8-iodo-4-keto-1-methyl-6-(morpholinomethyl)cinnoline-3-carboxylic acid ethyl ester Formula: C17H20IN3O4 MolecularWeight: 457.26287

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C(C=C(C=C2C1=O)CN3CCOCC3)I)C

Isomeric SMILES

CCOC(=O)C1=NN(C2=C(C=C(C=C2C1=O)CN3CCOCC3)I)C

InChI

InChI=1S/C17H20IN3O4/c1-3-25-17(23)14-16(22)12-8-11(10-21-4-6-24-7-5-21)9-13(18)15(12)20(2)19-14/h8-9H,3-7,10H2,1-2H3