2-[[6-iodanyl-3-[3-(morpholin-4-ylmethyl)-4-oxidanyl-phenyl]-4-oxidanylidene-quinazolin-2-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[6-iodanyl-3-[3-(morpholin-4-ylmethyl)-4-oxidanyl-phenyl]-4-oxidanylidene-quinazolin-2-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[3-[4-hydroxy-3-(morpholinomethyl)phenyl]-6-iodo-4-oxo-quinazolin-2-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[3-[4-hydroxy-3-(4-morpholinylmethyl)phenyl]-6-iodo-4-oxo-2-quinazolinyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[3-[4-hydroxy-3-(morpholin-4-ylmethyl)phenyl]-6-iodo-4-oxoquinazolin-2-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[3-[4-hydroxy-3-(morpholinomethyl)phenyl]-6-iodo-4-keto-quinazolin-2-yl]methyl]isoindoline-1,3-quinone Formula: C28H23IN4O5 MolecularWeight: 622.41049

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=C(C=CC(=C2)N3C(=NC4=C(C3=O)C=C(C=C4)I)CN5C(=O)C6=CC=CC=C6C5=O)O

Isomeric SMILES

C1COCCN1CC2=C(C=CC(=C2)N3C(=NC4=C(C3=O)C=C(C=C4)I)CN5C(=O)C6=CC=CC=C6C5=O)O

InChI

InChI=1S/C28H23IN4O5/c29-18-5-7-23-22(14-18)28(37)33(19-6-8-24(34)17(13-19)15-31-9-11-38-12-10-31)25(30-23)16-32-26(35)20-3-1-2-4-21(20)27(32)36/h1-8,13-14,34H,9-12,15-16H2