(3R)-6-nitro-2-oxidanylidene-1-(5-oxidanylidene-5-pyridin-3-yl-pentyl)-3,4-dihydroquinoline-3-carboxylate

Systemtic Name: (3R)-6-nitro-2-oxidanylidene-1-(5-oxidanylidene-5-pyridin-3-yl-pentyl)-3,4-dihydroquinoline-3-carboxylate Openeye Name: (3R)-6-nitro-2-oxo-1-[5-oxo-5-(3-pyridyl)pentyl]-3,4-dihydroquinoline-3-carboxylate CAS Name: (3R)-6-nitro-2-oxo-1-[5-oxo-5-(3-pyridinyl)pentyl]-3,4-dihydroquinoline-3-carboxylate IUPAC Name: (3R)-6-nitro-2-oxo-1-(5-oxo-5-pyridin-3-ylpentyl)-3,4-dihydroquinoline-3-carboxylate Traditional Name: (3R)-2-keto-1-[5-keto-5-(3-pyridyl)pentyl]-6-nitro-3,4-dihydroquinoline-3-carboxylate Formula: C20H18N3O6- MolecularWeight: 396.37342

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C2=C1C=C(C=C2)[N+](=O)[O-])CCCCC(=O)C3=CN=CC=C3)C(=O)[O-]

Isomeric SMILES

C1[C@H](C(=O)N(C2=C1C=C(C=C2)[N+](=O)[O-])CCCCC(=O)C3=CN=CC=C3)C(=O)[O-]

InChI

InChI=1S/C20H19N3O6/c24-18(13-4-3-8-21-12-13)5-1-2-9-22-17-7-6-15(23(28)29)10-14(17)11-16(19(22)25)20(26)27/h3-4,6-8,10,12,16H,1-2,5,9,11H2,(H,26,27)/p-1/t16-/m1/s1