2-[7-(dimethylamino)-6-nitro-3,4-dihydro-2H-quinoxalin-1-yl]ethanoic acid

Systemtic Name: 2-[7-(dimethylamino)-6-nitro-3,4-dihydro-2H-quinoxalin-1-yl]ethanoic acid Openeye Name: 2-[7-(dimethylamino)-6-nitro-3,4-dihydro-2H-quinoxalin-1-yl]acetic acid CAS Name: 2-[7-(dimethylamino)-6-nitro-3,4-dihydro-2H-quinoxalin-1-yl]acetic acid IUPAC Name: 2-[7-(dimethylamino)-6-nitro-3,4-dihydro-2H-quinoxalin-1-yl]acetic acid Traditional Name: 2-[7-(dimethylamino)-6-nitro-3,4-dihydro-2H-quinoxalin-1-yl]acetic acid Formula: C12H16N4O4 MolecularWeight: 280.27984

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C2C(=C1)N(CCN2)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C2C(=C1)N(CCN2)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O4/c1-14(2)10-6-9-8(5-11(10)16(19)20)13-3-4-15(9)7-12(17)18/h5-6,13H,3-4,7H2,1-2H3,(H,17,18)