N-[(4-chlorophenyl)methyl]-8-iodanyl-1-methyl-6-(morpholin-4-ylmethyl)-4-oxidanylidene-cinnoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-8-iodanyl-1-methyl-6-(morpholin-4-ylmethyl)-4-oxidanylidene-cinnoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-8-iodo-1-methyl-6-(morpholinomethyl)-4-oxo-cinnoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-8-iodo-1-methyl-6-(4-morpholinylmethyl)-4-oxo-3-cinnolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-8-iodo-1-methyl-6-(morpholin-4-ylmethyl)-4-oxocinnoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-8-iodo-4-keto-1-methyl-6-(morpholinomethyl)cinnoline-3-carboxamide Formula: C22H22ClIN4O3 MolecularWeight: 552.79255

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2C(=O)C(=N1)C(=O)NCC3=CC=C(C=C3)Cl)CN4CCOCC4)I

Isomeric SMILES

CN1C2=C(C=C(C=C2C(=O)C(=N1)C(=O)NCC3=CC=C(C=C3)Cl)CN4CCOCC4)I

InChI

InChI=1S/C22H22ClIN4O3/c1-27-20-17(10-15(11-18(20)24)13-28-6-8-31-9-7-28)21(29)19(26-27)22(30)25-12-14-2-4-16(23)5-3-14/h2-5,10-11H,6-9,12-13H2,1H3,(H,25,30)