(2S)-2-(3-iodanyl-5-methoxy-4-oxidanyl-phenyl)-3-methyl-1,2-dihydroquinazolin-4-one

Systemtic Name: (2S)-2-(3-iodanyl-5-methoxy-4-oxidanyl-phenyl)-3-methyl-1,2-dihydroquinazolin-4-one Openeye Name: (2S)-2-(4-hydroxy-3-iodo-5-methoxy-phenyl)-3-methyl-1,2-dihydroquinazolin-4-one CAS Name: (2S)-2-(4-hydroxy-3-iodo-5-methoxyphenyl)-3-methyl-1,2-dihydroquinazolin-4-one IUPAC Name: (2S)-2-(4-hydroxy-3-iodo-5-methoxyphenyl)-3-methyl-1,2-dihydroquinazolin-4-one Traditional Name: (2S)-2-(4-hydroxy-3-iodo-5-methoxy-phenyl)-3-methyl-1,2-dihydroquinazolin-4-one Formula: C16H15IN2O3 MolecularWeight: 410.20637

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(NC2=CC=CC=C2C1=O)C3=CC(=C(C(=C3)I)O)OC

Isomeric SMILES

CN1[C@H](NC2=CC=CC=C2C1=O)C3=CC(=C(C(=C3)I)O)OC

InChI

InChI=1S/C16H15IN2O3/c1-19-15(9-7-11(17)14(20)13(8-9)22-2)18-12-6-4-3-5-10(12)16(19)21/h3-8,15,18,20H,1-2H3/t15-/m0/s1