7-chloranyl-3-[(3S)-3-oxidanylbutyl]quinazolin-4-one

Systemtic Name: 7-chloranyl-3-[(3S)-3-oxidanylbutyl]quinazolin-4-one Openeye Name: 7-chloro-3-[(3S)-3-hydroxybutyl]quinazolin-4-one CAS Name: 7-chloro-3-[(3S)-3-hydroxybutyl]-4-quinazolinone IUPAC Name: 7-chloro-3-[(3S)-3-hydroxybutyl]quinazolin-4-one Traditional Name: 7-chloro-3-[(3S)-3-hydroxybutyl]quinazolin-4-one Formula: C12H13ClN2O2 MolecularWeight: 252.69682

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1C=NC2=C(C1=O)C=CC(=C2)Cl)O

Isomeric SMILES

C[C@@H](CCN1C=NC2=C(C1=O)C=CC(=C2)Cl)O

InChI

InChI=1S/C12H13ClN2O2/c1-8(16)4-5-15-7-14-11-6-9(13)2-3-10(11)12(15)17/h2-3,6-8,16H,4-5H2,1H3/t8-/m0/s1