1-methyl-6-nitro-2-oxidanylidene-N-[3-(5H-1,2,3,4-tetrazol-5-yl)phenyl]quinoline-3-carboxamide

Systemtic Name: 1-methyl-6-nitro-2-oxidanylidene-N-[3-(5H-1,2,3,4-tetrazol-5-yl)phenyl]quinoline-3-carboxamide Openeye Name: 1-methyl-6-nitro-2-oxo-N-[3-(5H-tetrazol-5-yl)phenyl]quinoline-3-carboxamide CAS Name: 1-methyl-6-nitro-2-oxo-N-[3-(5H-tetrazol-5-yl)phenyl]-3-quinolinecarboxamide IUPAC Name: 1-methyl-6-nitro-2-oxo-N-[3-(5H-tetrazol-5-yl)phenyl]quinoline-3-carboxamide Traditional Name: 2-keto-1-methyl-6-nitro-N-[3-(5H-tetrazol-5-yl)phenyl]quinoline-3-carboxamide Formula: C18H13N7O4 MolecularWeight: 391.34032

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)[N+](=O)[O-])C=C(C1=O)C(=O)NC3=CC=CC(=C3)C4N=NN=N4

Isomeric SMILES

CN1C2=C(C=C(C=C2)[N+](=O)[O-])C=C(C1=O)C(=O)NC3=CC=CC(=C3)C4N=NN=N4

InChI

InChI=1S/C18H13N7O4/c1-24-15-6-5-13(25(28)29)8-11(15)9-14(18(24)27)17(26)19-12-4-2-3-10(7-12)16-20-22-23-21-16/h2-9,16H,1H3,(H,19,26)