4-[(6-nitroquinolin-5-yl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(6-nitroquinolin-5-yl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(6-nitro-5-quinolyl)amino]-4-oxo-butanoic acid CAS Name: 4-[(6-nitro-5-quinolinyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[(6-nitroquinolin-5-yl)amino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[(6-nitro-5-quinolyl)amino]butyric acid Formula: C13H11N3O5 MolecularWeight: 289.24354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2NC(=O)CCC(=O)O)[N+](=O)[O-])N=C1

Isomeric SMILES

C1=CC2=C(C=CC(=C2NC(=O)CCC(=O)O)[N+](=O)[O-])N=C1

InChI

InChI=1S/C13H11N3O5/c17-11(5-6-12(18)19)15-13-8-2-1-7-14-9(8)3-4-10(13)16(20)21/h1-4,7H,5-6H2,(H,15,17)(H,18,19)