6-bromanyl-3-[(2S)-2-oxidanyl-3-(4-phenylphenoxy)propyl]quinazolin-4-one

Systemtic Name: 6-bromanyl-3-[(2S)-2-oxidanyl-3-(4-phenylphenoxy)propyl]quinazolin-4-one Openeye Name: 6-bromo-3-[(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]quinazolin-4-one CAS Name: 6-bromo-3-[(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]-4-quinazolinone IUPAC Name: 6-bromo-3-[(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]quinazolin-4-one Traditional Name: 6-bromo-3-[(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]quinazolin-4-one Formula: C23H19BrN2O3 MolecularWeight: 451.31256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)OCC(CN3C=NC4=C(C3=O)C=C(C=C4)Br)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)OC[C@H](CN3C=NC4=C(C3=O)C=C(C=C4)Br)O

InChI

InChI=1S/C23H19BrN2O3/c24-18-8-11-22-21(12-18)23(28)26(15-25-22)13-19(27)14-29-20-9-6-17(7-10-20)16-4-2-1-3-5-16/h1-12,15,19,27H,13-14H2/t19-/m0/s1