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ethanedioic acid; 4-[(5-nitrofuran-2-yl)methyl]thiomorpholine

ethanedioic acid; 4-[(5-nitrofuran-2-yl)methyl]thiomorpholine

Systemtic Name:ethanedioic acid; 4-[(5-nitrofuran-2-yl)methyl]thiomorpholine
Openeye Name:4-[(5-nitro-2-furyl)methyl]thiomorpholine; oxalic acid
CAS Name:4-[(5-nitro-2-furanyl)methyl]thiomorpholine; oxalic acid
IUPAC Name:4-[(5-nitrofuran-2-yl)methyl]thiomorpholine; oxalic acid
Traditional Name:4-[(5-nitro-2-furyl)methyl]thiomorpholine; oxalic acid
Formula: C11H14N2O7S
MolecularWeight: 318.30306
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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1CC2=CC=C(O2)[N+](=O)[O-].C(=O)(C(=O)O)O


Isomeric SMILES

C1CSCCN1CC2=CC=C(O2)[N+](=O)[O-].C(=O)(C(=O)O)O


InChI

InChI=1S/C9H12N2O3S.C2H2O4/c12-11(13)9-2-1-8(14-9)7-10-3-5-15-6-4-10;3-1(4)2(5)6/h1-2H,3-7H2;(H,3,4)(H,5,6)


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