methyl 4-(3-nitrophenyl)-4-oxidanyl-but-2-ynoate

Systemtic Name: methyl 4-(3-nitrophenyl)-4-oxidanyl-but-2-ynoate Openeye Name: methyl 4-hydroxy-4-(3-nitrophenyl)but-2-ynoate CAS Name: 4-hydroxy-4-(3-nitrophenyl)-2-butynoic acid methyl ester IUPAC Name: methyl 4-hydroxy-4-(3-nitrophenyl)but-2-ynoate Traditional Name: 4-hydroxy-4-(3-nitrophenyl)but-2-ynoic acid methyl ester Formula: C11H9NO5 MolecularWeight: 235.19286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9NO5/c1-17-11(14)6-5-10(13)8-3-2-4-9(7-8)12(15)16/h2-4,7,10,13H,1H3