pent-2-en-4-ynyl 4-nitrobenzoate

Systemtic Name: pent-2-en-4-ynyl 4-nitrobenzoate Openeye Name: pent-2-en-4-ynyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid pent-2-en-4-ynyl ester IUPAC Name: pent-2-en-4-ynyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid pent-2-en-4-ynyl ester Formula: C12H9NO4 MolecularWeight: 231.20416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9NO4/c1-2-3-4-9-17-12(14)10-5-7-11(8-6-10)13(15)16/h1,3-8H,9H2