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

Systemtic Name: 4-[methyl-(5-nitroquinolin-6-yl)amino]butanoic acid Openeye Name: 4-[methyl-(5-nitro-6-quinolyl)amino]butanoic acid CAS Name: 4-[methyl-(5-nitro-6-quinolinyl)amino]butanoic acid IUPAC Name: 4-[methyl-(5-nitroquinolin-6-yl)amino]butanoic acid Traditional Name: 4-[methyl-(5-nitro-6-quinolyl)amino]butyric acid Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C1=C(C2=C(C=C1)N=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN(CCCC(=O)O)C1=C(C2=C(C=C1)N=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O4/c1-16(9-3-5-13(18)19)12-7-6-11-10(4-2-8-15-11)14(12)17(20)21/h2,4,6-8H,3,5,9H2,1H3,(H,18,19)