2-methyl-6-nitro-4-oxidanylidene-1-phenyl-quinoline-3-carboxylate

Systemtic Name: 2-methyl-6-nitro-4-oxidanylidene-1-phenyl-quinoline-3-carboxylate Openeye Name: 2-methyl-6-nitro-4-oxo-1-phenyl-quinoline-3-carboxylate CAS Name: 2-methyl-6-nitro-4-oxo-1-phenyl-3-quinolinecarboxylate IUPAC Name: 2-methyl-6-nitro-4-oxo-1-phenylquinoline-3-carboxylate Traditional Name: 4-keto-2-methyl-6-nitro-1-phenyl-quinoline-3-carboxylate Formula: C17H11N2O5- MolecularWeight: 323.27964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(N1C3=CC=CC=C3)C=CC(=C2)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)C2=C(N1C3=CC=CC=C3)C=CC(=C2)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C17H12N2O5/c1-10-15(17(21)22)16(20)13-9-12(19(23)24)7-8-14(13)18(10)11-5-3-2-4-6-11/h2-9H,1H3,(H,21,22)/p-1