1-(3-nitro-5-quinolin-8-yloxy-1,2,4-triazol-1-yl)propan-2-one

Systemtic Name: 1-(3-nitro-5-quinolin-8-yloxy-1,2,4-triazol-1-yl)propan-2-one Openeye Name: 1-[3-nitro-5-(8-quinolyloxy)-1,2,4-triazol-1-yl]propan-2-one CAS Name: 1-[3-nitro-5-(8-quinolinyloxy)-1,2,4-triazol-1-yl]-2-propanone IUPAC Name: 1-(3-nitro-5-quinolin-8-yloxy-1,2,4-triazol-1-yl)propan-2-one Traditional Name: 1-[3-nitro-5-(8-quinolyloxy)-1,2,4-triazol-1-yl]acetone Formula: C14H11N5O4 MolecularWeight: 313.26824

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C(=NC(=N1)[N+](=O)[O-])OC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CC(=O)CN1C(=NC(=N1)[N+](=O)[O-])OC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C14H11N5O4/c1-9(20)8-18-14(16-13(17-18)19(21)22)23-11-6-2-4-10-5-3-7-15-12(10)11/h2-7H,8H2,1H3