tert-butyl N-[(E)-6-isocyano-3-methyl-2-oxidanylidene-hex-4-en-3-yl]carbamate

Systemtic Name: tert-butyl N-[(E)-6-isocyano-3-methyl-2-oxidanylidene-hex-4-en-3-yl]carbamate Openeye Name: tert-butyl N-[(E)-1-acetyl-4-isocyano-1-methyl-but-2-enyl]carbamate CAS Name: N-[(E)-6-isocyano-3-methyl-2-oxohex-4-en-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E)-6-isocyano-3-methyl-2-oxohex-4-en-3-yl]carbamate Traditional Name: N-[(E)-1-acetyl-4-isocyano-1-methyl-but-2-enyl]carbamic acid tert-butyl ester Formula: C13H20N2O3 MolecularWeight: 252.3095

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C=CC[N+]#[C-])NC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)C(C)(/C=C/C[N+]#[C-])NC(=O)OC(C)(C)C

InChI

InChI=1S/C13H20N2O3/c1-10(16)13(5,8-7-9-14-6)15-11(17)18-12(2,3)4/h7-8H,9H2,1-5H3,(H,15,17)/b8-7+