prop-2-ynyl 3,5-dinitrobenzoate

Systemtic Name: prop-2-ynyl 3,5-dinitrobenzoate Openeye Name: prop-2-ynyl 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid propargyl ester Formula: C10H6N2O6 MolecularWeight: 250.16444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H6N2O6/c1-2-3-18-10(13)7-4-8(11(14)15)6-9(5-7)12(16)17/h1,4-6H,3H2