3-[(7-nitro-2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)amino]propanoic acid

Systemtic Name: 3-[(7-nitro-2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)amino]propanoic acid Openeye Name: 3-[(7-nitro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]propanoic acid CAS Name: 3-[(7-nitro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]propanoic acid IUPAC Name: 3-[(7-nitro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]propanoic acid Traditional Name: 3-[(2-keto-7-nitro-3,4-dihydro-1H-quinolin-6-yl)amino]propionic acid Formula: C12H13N3O5 MolecularWeight: 279.24872

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=CC(=C(C=C21)NCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)NC2=CC(=C(C=C21)NCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O5/c16-11-2-1-7-5-9(13-4-3-12(17)18)10(15(19)20)6-8(7)14-11/h5-6,13H,1-4H2,(H,14,16)(H,17,18)