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

Systemtic Name: N-[(4-chlorophenyl)methyl]-8-iodanyl-6-(morpholin-4-ylmethyl)-4-oxidanylidene-1H-cinnoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-8-iodo-6-(morpholinomethyl)-4-oxo-1H-cinnoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-8-iodo-6-(4-morpholinylmethyl)-4-oxo-1H-cinnoline-3-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-8-iodo-6-(morpholin-4-ylmethyl)-4-oxo-1H-cinnoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-8-iodo-4-keto-6-(morpholinomethyl)-1H-cinnoline-3-carboxamide Formula: C21H20ClIN4O3 MolecularWeight: 538.76597

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC(=C3C(=C2)C(=O)C(=NN3)C(=O)NCC4=CC=C(C=C4)Cl)I

Isomeric SMILES

C1COCCN1CC2=CC(=C3C(=C2)C(=O)C(=NN3)C(=O)NCC4=CC=C(C=C4)Cl)I

InChI

InChI=1S/C21H20ClIN4O3/c22-15-3-1-13(2-4-15)11-24-21(29)19-20(28)16-9-14(10-17(23)18(16)25-26-19)12-27-5-7-30-8-6-27/h1-4,9-10H,5-8,11-12H2,(H,24,29)(H,25,28)