6-(benzotriazol-1-yl)-6-ethoxy-5-methyl-oct-7-en-3-one

Systemtic Name: 6-(benzotriazol-1-yl)-6-ethoxy-5-methyl-oct-7-en-3-one Openeye Name: 6-(benzotriazol-1-yl)-6-ethoxy-5-methyl-oct-7-en-3-one CAS Name: 6-(1-benzotriazolyl)-6-ethoxy-5-methyl-7-octen-3-one IUPAC Name: 6-(benzotriazol-1-yl)-6-ethoxy-5-methyloct-7-en-3-one Traditional Name: 6-(benzotriazol-1-yl)-6-ethoxy-5-methyl-oct-7-en-3-one Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC(C)C(C=C)(N1C2=CC=CC=C2N=N1)OCC

Isomeric SMILES

CCC(=O)CC(C)C(C=C)(N1C2=CC=CC=C2N=N1)OCC

InChI

InChI=1S/C17H23N3O2/c1-5-14(21)12-13(4)17(6-2,22-7-3)20-16-11-9-8-10-15(16)18-19-20/h6,8-11,13H,2,5,7,12H2,1,3-4H3