(2S)-2-(5-methoxy-2-nitro-4-oxidanyl-phenyl)-2,3-dihydro-1H-quinazolin-4-one

Systemtic Name: (2S)-2-(5-methoxy-2-nitro-4-oxidanyl-phenyl)-2,3-dihydro-1H-quinazolin-4-one Openeye Name: (2S)-2-(4-hydroxy-5-methoxy-2-nitro-phenyl)-2,3-dihydro-1H-quinazolin-4-one CAS Name: (2S)-2-(4-hydroxy-5-methoxy-2-nitrophenyl)-2,3-dihydro-1H-quinazolin-4-one IUPAC Name: (2S)-2-(4-hydroxy-5-methoxy-2-nitrophenyl)-2,3-dihydro-1H-quinazolin-4-one Traditional Name: (2S)-2-(4-hydroxy-5-methoxy-2-nitro-phenyl)-2,3-dihydro-1H-quinazolin-4-one Formula: C15H13N3O5 MolecularWeight: 315.28082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C2NC3=CC=CC=C3C(=O)N2)[N+](=O)[O-])O

Isomeric SMILES

COC1=C(C=C(C(=C1)[C@H]2NC3=CC=CC=C3C(=O)N2)[N+](=O)[O-])O

InChI

InChI=1S/C15H13N3O5/c1-23-13-6-9(11(18(21)22)7-12(13)19)14-16-10-5-3-2-4-8(10)15(20)17-14/h2-7,14,16,19H,1H3,(H,17,20)/t14-/m0/s1