but-3-yn-2-yl 4-nitrobenzoate

Systemtic Name: but-3-yn-2-yl 4-nitrobenzoate Openeye Name: 1-methylprop-2-ynyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid but-3-yn-2-yl ester IUPAC Name: but-3-yn-2-yl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 1-methylprop-2-ynyl ester Formula: C11H9NO4 MolecularWeight: 219.19346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9NO4/c1-3-8(2)16-11(13)9-4-6-10(7-5-9)12(14)15/h1,4-8H,2H3