3,3-dimethyl-1-quinolin-8-yloxy-1-(1,2,4-triazol-1-yl)butan-2-one

Systemtic Name: 3,3-dimethyl-1-quinolin-8-yloxy-1-(1,2,4-triazol-1-yl)butan-2-one Openeye Name: 3,3-dimethyl-1-(8-quinolyloxy)-1-(1,2,4-triazol-1-yl)butan-2-one CAS Name: 3,3-dimethyl-1-(8-quinolinyloxy)-1-(1,2,4-triazol-1-yl)-2-butanone IUPAC Name: 3,3-dimethyl-1-quinolin-8-yloxy-1-(1,2,4-triazol-1-yl)butan-2-one Traditional Name: 3,3-dimethyl-1-(8-quinolyloxy)-1-(1,2,4-triazol-1-yl)butan-2-one Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(N1C=NC=N1)OC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)C(N1C=NC=N1)OC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C17H18N4O2/c1-17(2,3)15(22)16(21-11-18-10-20-21)23-13-8-4-6-12-7-5-9-19-14(12)13/h4-11,16H,1-3H3