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

Systemtic Name: 6-bromanyl-3-[2-oxidanyl-3-(4-propanoylphenoxy)propyl]quinazolin-4-one Openeye Name: 6-bromo-3-[2-hydroxy-3-(4-propanoylphenoxy)propyl]quinazolin-4-one CAS Name: 6-bromo-3-[2-hydroxy-3-[4-(1-oxopropyl)phenoxy]propyl]-4-quinazolinone IUPAC Name: 6-bromo-3-[2-hydroxy-3-(4-propanoylphenoxy)propyl]quinazolin-4-one Traditional Name: 6-bromo-3-[2-hydroxy-3-(4-propionylphenoxy)propyl]quinazolin-4-one Formula: C20H19BrN2O4 MolecularWeight: 431.27986

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(CN2C=NC3=C(C2=O)C=C(C=C3)Br)O

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(CN2C=NC3=C(C2=O)C=C(C=C3)Br)O

InChI

InChI=1S/C20H19BrN2O4/c1-2-19(25)13-3-6-16(7-4-13)27-11-15(24)10-23-12-22-18-8-5-14(21)9-17(18)20(23)26/h3-9,12,15,24H,2,10-11H2,1H3