ethyl 2-(2-ethoxycarbonylprop-2-enyl)-5-nitro-benzoate

Systemtic Name: ethyl 2-(2-ethoxycarbonylprop-2-enyl)-5-nitro-benzoate Openeye Name: ethyl 2-(2-ethoxycarbonylallyl)-5-nitro-benzoate CAS Name: 2-(2-ethoxycarbonylprop-2-enyl)-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 2-(2-ethoxycarbonylprop-2-enyl)-5-nitrobenzoate Traditional Name: 2-(2-carbethoxyallyl)-5-nitro-benzoic acid ethyl ester Formula: C15H17NO6 MolecularWeight: 307.29858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])CC(=C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])CC(=C)C(=O)OCC

InChI

InChI=1S/C15H17NO6/c1-4-21-14(17)10(3)8-11-6-7-12(16(19)20)9-13(11)15(18)22-5-2/h6-7,9H,3-5,8H2,1-2H3