4-[(5-nitroquinolin-8-yl)amino]butanoic acid

Systemtic Name: 4-[(5-nitroquinolin-8-yl)amino]butanoic acid Openeye Name: 4-[(5-nitro-8-quinolyl)amino]butanoic acid CAS Name: 4-[(5-nitro-8-quinolinyl)amino]butanoic acid IUPAC Name: 4-[(5-nitroquinolin-8-yl)amino]butanoic acid Traditional Name: 4-[(5-nitro-8-quinolyl)amino]butyric acid Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2N=C1)NCCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CC(=C2N=C1)NCCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O4/c17-12(18)4-2-7-14-10-5-6-11(16(19)20)9-3-1-8-15-13(9)10/h1,3,5-6,8,14H,2,4,7H2,(H,17,18)