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

Systemtic Name: 3-[(2S)-3-(3-bromanylphenoxy)-2-oxidanyl-propyl]-6-chloranyl-quinazolin-4-one Openeye Name: 3-[(2S)-3-(3-bromophenoxy)-2-hydroxy-propyl]-6-chloro-quinazolin-4-one CAS Name: 3-[(2S)-3-(3-bromophenoxy)-2-hydroxypropyl]-6-chloro-4-quinazolinone IUPAC Name: 3-[(2S)-3-(3-bromophenoxy)-2-hydroxypropyl]-6-chloroquinazolin-4-one Traditional Name: 3-[(2S)-3-(3-bromophenoxy)-2-hydroxy-propyl]-6-chloro-quinazolin-4-one Formula: C17H14BrClN2O3 MolecularWeight: 409.66166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=CC(=C1)Br)OC[C@H](CN2C=NC3=C(C2=O)C=C(C=C3)Cl)O

InChI

InChI=1S/C17H14BrClN2O3/c18-11-2-1-3-14(6-11)24-9-13(22)8-21-10-20-16-5-4-12(19)7-15(16)17(21)23/h1-7,10,13,22H,8-9H2/t13-/m0/s1