3-[(2S)-3-(4-bromanylphenoxy)-2-oxidanyl-propyl]-6,8-bis(chloranyl)quinazolin-4-one

Systemtic Name: 3-[(2S)-3-(4-bromanylphenoxy)-2-oxidanyl-propyl]-6,8-bis(chloranyl)quinazolin-4-one Openeye Name: 3-[(2S)-3-(4-bromophenoxy)-2-hydroxy-propyl]-6,8-dichloro-quinazolin-4-one CAS Name: 3-[(2S)-3-(4-bromophenoxy)-2-hydroxypropyl]-6,8-dichloro-4-quinazolinone IUPAC Name: 3-[(2S)-3-(4-bromophenoxy)-2-hydroxypropyl]-6,8-dichloroquinazolin-4-one Traditional Name: 3-[(2S)-3-(4-bromophenoxy)-2-hydroxy-propyl]-6,8-dichloro-quinazolin-4-one Formula: C17H13BrCl2N2O3 MolecularWeight: 444.10672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC(CN2C=NC3=C(C=C(C=C3C2=O)Cl)Cl)O)Br

Isomeric SMILES

C1=CC(=CC=C1OC[C@H](CN2C=NC3=C(C=C(C=C3C2=O)Cl)Cl)O)Br

InChI

InChI=1S/C17H13BrCl2N2O3/c18-10-1-3-13(4-2-10)25-8-12(23)7-22-9-21-16-14(17(22)24)5-11(19)6-15(16)20/h1-6,9,12,23H,7-8H2/t12-/m0/s1