(E)-3-[(1R)-1-(benzotriazol-1-yl)ethyl]-4-oxidanyl-pent-3-en-2-one

Systemtic Name: (E)-3-[(1R)-1-(benzotriazol-1-yl)ethyl]-4-oxidanyl-pent-3-en-2-one Openeye Name: (E)-3-[(1R)-1-(benzotriazol-1-yl)ethyl]-4-hydroxy-pent-3-en-2-one CAS Name: (E)-3-[(1R)-1-(1-benzotriazolyl)ethyl]-4-hydroxy-3-penten-2-one IUPAC Name: (E)-3-[(1R)-1-(benzotriazol-1-yl)ethyl]-4-hydroxypent-3-en-2-one Traditional Name: (E)-3-[(1R)-1-(benzotriazol-1-yl)ethyl]-4-hydroxy-pent-3-en-2-one Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](/C(=C(/C)\O)/C(=O)C)N1C2=CC=CC=C2N=N1

InChI

InChI=1S/C13H15N3O2/c1-8(13(9(2)17)10(3)18)16-12-7-5-4-6-11(12)14-15-16/h4-8,17H,1-3H3/b13-9+/t8-/m1/s1