3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-ethyl-5-isocyano-1,3-oxazol-2-one

Systemtic Name: 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-ethyl-5-isocyano-1,3-oxazol-2-one Openeye Name: 3-[(3,5-dimethylisoxazol-4-yl)methyl]-4-ethyl-5-isocyano-oxazol-2-one CAS Name: 3-[(3,5-dimethyl-4-isoxazolyl)methyl]-4-ethyl-5-isocyano-2-oxazolone IUPAC Name: 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-ethyl-5-isocyano-1,3-oxazol-2-one Traditional Name: 3-[(3,5-dimethylisoxazol-4-yl)methyl]-4-ethyl-5-isocyano-4-oxazolin-2-one Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(OC(=O)N1CC2=C(ON=C2C)C)[N+]#[C-]

Isomeric SMILES

CCC1=C(OC(=O)N1CC2=C(ON=C2C)C)[N+]#[C-]

InChI

InChI=1S/C12H13N3O3/c1-5-10-11(13-4)17-12(16)15(10)6-9-7(2)14-18-8(9)3/h5-6H2,1-3H3