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

Systemtic Name: 4-[(5-nitroquinolin-6-yl)amino]butanoic acid Openeye Name: 4-[(5-nitro-6-quinolyl)amino]butanoic acid CAS Name: 4-[(5-nitro-6-quinolinyl)amino]butanoic acid IUPAC Name: 4-[(5-nitroquinolin-6-yl)amino]butanoic acid Traditional Name: 4-[(5-nitro-6-quinolyl)amino]butyric acid Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2[N+](=O)[O-])NCCCC(=O)O)N=C1

Isomeric SMILES

C1=CC2=C(C=CC(=C2[N+](=O)[O-])NCCCC(=O)O)N=C1

InChI

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