methyl (Z)-3-bromanyl-2-isocyano-but-2-enoate

Systemtic Name: methyl (Z)-3-bromanyl-2-isocyano-but-2-enoate Openeye Name: methyl (Z)-3-bromo-2-isocyano-but-2-enoate CAS Name: (Z)-3-bromo-2-isocyano-2-butenoic acid methyl ester IUPAC Name: methyl (Z)-3-bromo-2-isocyanobut-2-enoate Traditional Name: (Z)-3-bromo-2-isocyano-but-2-enoic acid methyl ester Formula: C6H6BrNO2 MolecularWeight: 204.02134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=C(\C(=O)OC)/[N+]#[C-])/Br

InChI

InChI=1S/C6H6BrNO2/c1-4(7)5(8-2)6(9)10-3/h1,3H3/b5-4-