4-nitro-2-[[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]methyl]phenolate

Systemtic Name: 4-nitro-2-[[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]methyl]phenolate Openeye Name: 4-nitro-2-[[[2-(4-pyridyl)quinoline-4-carbonyl]amino]methyl]phenolate CAS Name: 4-nitro-2-[[[oxo-(2-pyridin-4-yl-4-quinolinyl)methyl]amino]methyl]phenolate IUPAC Name: 4-nitro-2-[[(2-pyridin-4-ylquinoline-4-carbonyl)amino]methyl]phenolate Traditional Name: 4-nitro-2-[[[2-(4-pyridyl)quinoline-4-carbonyl]amino]methyl]phenolate Formula: C22H15N4O4- MolecularWeight: 399.3789

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=NC=C3)C(=O)NCC4=C(C=CC(=C4)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=NC=C3)C(=O)NCC4=C(C=CC(=C4)[N+](=O)[O-])[O-]

InChI

InChI=1S/C22H16N4O4/c27-21-6-5-16(26(29)30)11-15(21)13-24-22(28)18-12-20(14-7-9-23-10-8-14)25-19-4-2-1-3-17(18)19/h1-12,27H,13H2,(H,24,28)/p-1