1-(6-fluoranyl-2,2-dimethyl-quinolin-1-yl)carbonyl-4-(2-oxidanylidenepropyl)-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-(6-fluoranyl-2,2-dimethyl-quinolin-1-yl)carbonyl-4-(2-oxidanylidenepropyl)-1,2,3,4-tetrazol-5-one Openeye Name: 1-acetonyl-4-(6-fluoro-2,2-dimethyl-quinoline-1-carbonyl)tetrazol-5-one CAS Name: 1-[(6-fluoro-2,2-dimethyl-1-quinolinyl)-oxomethyl]-4-(2-oxopropyl)-5-tetrazolone IUPAC Name: 1-(6-fluoro-2,2-dimethylquinoline-1-carbonyl)-4-(2-oxopropyl)tetrazol-5-one Traditional Name: 1-acetonyl-4-(6-fluoro-2,2-dimethyl-quinoline-1-carbonyl)tetrazol-5-one Formula: C16H16FN5O3 MolecularWeight: 345.328343

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C(=O)N(N=N1)C(=O)N2C3=C(C=CC2(C)C)C=C(C=C3)F

Isomeric SMILES

CC(=O)CN1C(=O)N(N=N1)C(=O)N2C3=C(C=CC2(C)C)C=C(C=C3)F

InChI

InChI=1S/C16H16FN5O3/c1-10(23)9-20-14(24)22(19-18-20)15(25)21-13-5-4-12(17)8-11(13)6-7-16(21,2)3/h4-8H,9H2,1-3H3