diethyl (E)-2-isocyanobut-2-enedioate

Systemtic Name: diethyl (E)-2-isocyanobut-2-enedioate Openeye Name: diethyl (E)-2-isocyanobut-2-enedioate CAS Name: (E)-2-isocyano-2-butenedioic acid diethyl ester IUPAC Name: diethyl (E)-2-isocyanobut-2-enedioate Traditional Name: (E)-2-isocyanobut-2-enedioic acid diethyl ester Formula: C9H11NO4 MolecularWeight: 197.18794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C(=O)OCC)[N+]#[C-]

Isomeric SMILES

CCOC(=O)/C=C(\C(=O)OCC)/[N+]#[C-]

InChI

InChI=1S/C9H11NO4/c1-4-13-8(11)6-7(10-3)9(12)14-5-2/h6H,4-5H2,1-2H3/b7-6+