N-[(4-chlorophenyl)methyl]-1-(3-iodanylphenyl)-6-(morpholin-4-ylmethyl)-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-(3-iodanylphenyl)-6-(morpholin-4-ylmethyl)-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-1-(3-iodophenyl)-6-(morpholinomethyl)-4-oxo-quinoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-1-(3-iodophenyl)-6-(4-morpholinylmethyl)-4-oxo-3-quinolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-1-(3-iodophenyl)-6-(morpholin-4-ylmethyl)-4-oxoquinoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-1-(3-iodophenyl)-4-keto-6-(morpholinomethyl)quinoline-3-carboxamide Formula: C28H25ClIN3O3 MolecularWeight: 613.87387

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC3=C(C=C2)N(C=C(C3=O)C(=O)NCC4=CC=C(C=C4)Cl)C5=CC(=CC=C5)I

Isomeric SMILES

C1COCCN1CC2=CC3=C(C=C2)N(C=C(C3=O)C(=O)NCC4=CC=C(C=C4)Cl)C5=CC(=CC=C5)I

InChI

InChI=1S/C28H25ClIN3O3/c29-21-7-4-19(5-8-21)16-31-28(35)25-18-33(23-3-1-2-22(30)15-23)26-9-6-20(14-24(26)27(25)34)17-32-10-12-36-13-11-32/h1-9,14-15,18H,10-13,16-17H2,(H,31,35)