1-[4-[(E)-butylideneamino]-5-(2-oxidanylidenepropyl)-1,2,4-triazol-3-yl]propan-2-one

Systemtic Name: 1-[4-[(E)-butylideneamino]-5-(2-oxidanylidenepropyl)-1,2,4-triazol-3-yl]propan-2-one Openeye Name: 1-[5-acetonyl-4-[(E)-butylideneamino]-1,2,4-triazol-3-yl]propan-2-one CAS Name: 1-[4-[(E)-butylideneamino]-5-(2-oxopropyl)-1,2,4-triazol-3-yl]-2-propanone IUPAC Name: 1-[4-[(E)-butylideneamino]-5-(2-oxopropyl)-1,2,4-triazol-3-yl]propan-2-one Traditional Name: 1-[5-acetonyl-4-[(E)-butylideneamino]-1,2,4-triazol-3-yl]acetone Formula: C12H18N4O2 MolecularWeight: 250.29692

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=NN1C(=NN=C1CC(=O)C)CC(=O)C

Isomeric SMILES

CCC/C=N/N1C(=NN=C1CC(=O)C)CC(=O)C

InChI

InChI=1S/C12H18N4O2/c1-4-5-6-13-16-11(7-9(2)17)14-15-12(16)8-10(3)18/h6H,4-5,7-8H2,1-3H3/b13-6+