[(E)-2-methoxycarbonylbut-2-enyl] 4-nitrobenzoate

Systemtic Name: [(E)-2-methoxycarbonylbut-2-enyl] 4-nitrobenzoate Openeye Name: [(E)-2-methoxycarbonylbut-2-enyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(E)-2-methoxycarbonylbut-2-enyl] ester IUPAC Name: [(E)-2-methoxycarbonylbut-2-enyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(E)-2-carbomethoxybut-2-enyl] ester Formula: C13H13NO6 MolecularWeight: 279.24542

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(COC(=O)C1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

C/C=C(\COC(=O)C1=CC=C(C=C1)[N+](=O)[O-])/C(=O)OC

InChI

InChI=1S/C13H13NO6/c1-3-9(12(15)19-2)8-20-13(16)10-4-6-11(7-5-10)14(17)18/h3-7H,8H2,1-2H3/b9-3+