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

Systemtic Name: 3-[(7-nitro-2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)amino]butanoic acid Openeye Name: 3-[(7-nitro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]butanoic acid CAS Name: 3-[(7-nitro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]butanoic acid IUPAC Name: 3-[(7-nitro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]butanoic acid Traditional Name: 3-[(2-keto-7-nitro-3,4-dihydro-1H-quinolin-6-yl)amino]butyric acid Formula: C13H15N3O5 MolecularWeight: 293.2753

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC1=C(C=C2C(=C1)CCC(=O)N2)[N+](=O)[O-]

Isomeric SMILES

CC(CC(=O)O)NC1=C(C=C2C(=C1)CCC(=O)N2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O5/c1-7(4-13(18)19)14-10-5-8-2-3-12(17)15-9(8)6-11(10)16(20)21/h5-7,14H,2-4H2,1H3,(H,15,17)(H,18,19)