(4-nitrophenyl)methyl 4-oxidanylidene-4-thiophen-2-yl-butanoate

Systemtic Name: (4-nitrophenyl)methyl 4-oxidanylidene-4-thiophen-2-yl-butanoate Openeye Name: (4-nitrophenyl)methyl 4-oxo-4-(2-thienyl)butanoate CAS Name: 4-oxo-4-thiophen-2-ylbutanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-oxo-4-thiophen-2-ylbutanoate Traditional Name: 4-keto-4-(2-thienyl)butyric acid (4-nitrobenzyl) ester Formula: C15H13NO5S MolecularWeight: 319.33242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)CCC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)C(=O)CCC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H13NO5S/c17-13(14-2-1-9-22-14)7-8-15(18)21-10-11-3-5-12(6-4-11)16(19)20/h1-6,9H,7-8,10H2