[4-(4-nitrophenyl)-1,3-dioxan-5-yl] thiophene-2-carboxylate

Systemtic Name: [4-(4-nitrophenyl)-1,3-dioxan-5-yl] thiophene-2-carboxylate Openeye Name: [4-(4-nitrophenyl)-1,3-dioxan-5-yl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [4-(4-nitrophenyl)-1,3-dioxan-5-yl] ester IUPAC Name: [4-(4-nitrophenyl)-1,3-dioxan-5-yl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [4-(4-nitrophenyl)-1,3-dioxan-5-yl] ester Formula: C15H13NO6S MolecularWeight: 335.33182

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OCO1)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=CS3

Isomeric SMILES

C1C(C(OCO1)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=CS3

InChI

InChI=1S/C15H13NO6S/c17-15(13-2-1-7-23-13)22-12-8-20-9-21-14(12)10-3-5-11(6-4-10)16(18)19/h1-7,12,14H,8-9H2