1-isocyanato-4-methyl-pent-4-ene-1,3-dione

Systemtic Name: 1-isocyanato-4-methyl-pent-4-ene-1,3-dione Openeye Name: 4-methyl-3-oxo-pent-4-enoyl isocyanate CAS Name: 1-isocyanato-4-methyl-4-pentene-1,3-dione IUPAC Name: 4-methyl-3-oxopent-4-enoyl isocyanate Traditional Name: 1-isocyanato-4-methyl-pent-4-ene-1,3-dione Formula: C7H7NO3 MolecularWeight: 153.13538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H7NO3/c1-5(2)6(10)3-7(11)8-4-9/h1,3H2,2H3