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

Systemtic Name: 2-[[(2-methylquinolin-4-yl)carbonylamino]methyl]-4-nitro-phenolate Openeye Name: 2-[[(2-methylquinoline-4-carbonyl)amino]methyl]-4-nitro-phenolate CAS Name: 2-[[[(2-methyl-4-quinolinyl)-oxomethyl]amino]methyl]-4-nitrophenolate IUPAC Name: 2-[[(2-methylquinoline-4-carbonyl)amino]methyl]-4-nitrophenolate Traditional Name: 2-[[(2-methylquinoline-4-carbonyl)amino]methyl]-4-nitro-phenolate Formula: C18H14N3O4- MolecularWeight: 336.32146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C18H15N3O4/c1-11-8-15(14-4-2-3-5-16(14)20-11)18(23)19-10-12-9-13(21(24)25)6-7-17(12)22/h2-9,22H,10H2,1H3,(H,19,23)/p-1