(E)-2,2-dimethyl-8-phenoxy-4-(1,2,4-triazol-1-yl)oct-6-en-3-one

Systemtic Name: (E)-2,2-dimethyl-8-phenoxy-4-(1,2,4-triazol-1-yl)oct-6-en-3-one Openeye Name: (E)-2,2-dimethyl-8-phenoxy-4-(1,2,4-triazol-1-yl)oct-6-en-3-one CAS Name: (E)-2,2-dimethyl-8-phenoxy-4-(1,2,4-triazol-1-yl)-6-octen-3-one IUPAC Name: (E)-2,2-dimethyl-8-phenoxy-4-(1,2,4-triazol-1-yl)oct-6-en-3-one Traditional Name: (E)-2,2-dimethyl-8-phenoxy-4-(1,2,4-triazol-1-yl)oct-6-en-3-one Formula: C18H23N3O2 MolecularWeight: 313.39412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(CC=CCOC1=CC=CC=C1)N2C=NC=N2

Isomeric SMILES

CC(C)(C)C(=O)C(C/C=C/COC1=CC=CC=C1)N2C=NC=N2

InChI

InChI=1S/C18H23N3O2/c1-18(2,3)17(22)16(21-14-19-13-20-21)11-7-8-12-23-15-9-5-4-6-10-15/h4-10,13-14,16H,11-12H2,1-3H3/b8-7+