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(3-nitrophenyl)methyl 2-quinoxalin-2-ylsulfanylethanoate

(3-nitrophenyl)methyl 2-quinoxalin-2-ylsulfanylethanoate

Systemtic Name:(3-nitrophenyl)methyl 2-quinoxalin-2-ylsulfanylethanoate
Openeye Name:(3-nitrophenyl)methyl 2-quinoxalin-2-ylsulfanylacetate
CAS Name:2-(2-quinoxalinylthio)acetic acid (3-nitrophenyl)methyl ester
IUPAC Name:(3-nitrophenyl)methyl 2-quinoxalin-2-ylsulfanylacetate
Traditional Name:2-(quinoxalin-2-ylthio)acetic acid (3-nitrobenzyl) ester
Formula: C17H13N3O4S
MolecularWeight: 355.36782
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CC(=N2)SCC(=O)OCC3=CC(=CC=C3)[N+](=O)[O-]


Isomeric SMILES

C1=CC=C2C(=C1)N=CC(=N2)SCC(=O)OCC3=CC(=CC=C3)[N+](=O)[O-]


InChI

InChI=1S/C17H13N3O4S/c21-17(24-10-12-4-3-5-13(8-12)20(22)23)11-25-16-9-18-14-6-1-2-7-15(14)19-16/h1-9H,10-11H2


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