2-[(2,3-dimethoxy-7-nitro-quinoxalin-5-yl)methoxy]ethanoic acid

Systemtic Name: 2-[(2,3-dimethoxy-7-nitro-quinoxalin-5-yl)methoxy]ethanoic acid Openeye Name: 2-[(2,3-dimethoxy-7-nitro-quinoxalin-5-yl)methoxy]acetic acid CAS Name: 2-[(2,3-dimethoxy-7-nitro-5-quinoxalinyl)methoxy]acetic acid IUPAC Name: 2-[(2,3-dimethoxy-7-nitroquinoxalin-5-yl)methoxy]acetic acid Traditional Name: 2-[(2,3-dimethoxy-7-nitro-quinoxalin-5-yl)methoxy]acetic acid Formula: C13H13N3O7 MolecularWeight: 323.25822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=C(C(=CC(=C2)[N+](=O)[O-])COCC(=O)O)N=C1OC

Isomeric SMILES

COC1=NC2=C(C(=CC(=C2)[N+](=O)[O-])COCC(=O)O)N=C1OC

InChI

InChI=1S/C13H13N3O7/c1-21-12-13(22-2)15-11-7(5-23-6-10(17)18)3-8(16(19)20)4-9(11)14-12/h3-4H,5-6H2,1-2H3,(H,17,18)