(2E,5E)-4-ethanoylhepta-2,5-dienediamide; propan-2-one

Systemtic Name: (2E,5E)-4-ethanoylhepta-2,5-dienediamide; propan-2-one Openeye Name: acetone; (2E,5E)-4-acetylhepta-2,5-dienediamide CAS Name: (2E,5E)-4-acetylhepta-2,5-dienediamide; 2-propanone IUPAC Name: (2E,5E)-4-acetylhepta-2,5-dienediamide; propan-2-one Traditional Name: acetone; (2E,5E)-4-acetylhepta-2,5-dienediamide Formula: C12H18N2O4 MolecularWeight: 254.28232

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C.CC(=O)C(C=CC(=O)N)C=CC(=O)N

Isomeric SMILES

CC(=O)C.CC(=O)C(/C=C/C(=O)N)/C=C/C(=O)N

InChI

InChI=1S/C9H12N2O3.C3H6O/c1-6(12)7(2-4-8(10)13)3-5-9(11)14;1-3(2)4/h2-5,7H,1H3,(H2,10,13)(H2,11,14);1-2H3/b4-2+,5-3+;