3-[2-(3-methoxy-4-oxidanyl-phenyl)-2-oxidanyl-ethanoyl]-7-nitro-1H-quinoxalin-2-one

Systemtic Name: 3-[2-(3-methoxy-4-oxidanyl-phenyl)-2-oxidanyl-ethanoyl]-7-nitro-1H-quinoxalin-2-one Openeye Name: 3-[2-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)acetyl]-7-nitro-1H-quinoxalin-2-one CAS Name: 3-[2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-oxoethyl]-7-nitro-1H-quinoxalin-2-one IUPAC Name: 3-[2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetyl]-7-nitro-1H-quinoxalin-2-one Traditional Name: 3-[2-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)acetyl]-7-nitro-1H-quinoxalin-2-one Formula: C17H13N3O7 MolecularWeight: 371.30102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C(=O)C2=NC3=C(C=C(C=C3)[N+](=O)[O-])NC2=O)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(C(=O)C2=NC3=C(C=C(C=C3)[N+](=O)[O-])NC2=O)O)O

InChI

InChI=1S/C17H13N3O7/c1-27-13-6-8(2-5-12(13)21)15(22)16(23)14-17(24)19-11-7-9(20(25)26)3-4-10(11)18-14/h2-7,15,21-22H,1H3,(H,19,24)