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1,3-thiazol-5-ylmethyl 4-nitrobenzoate

1,3-thiazol-5-ylmethyl 4-nitrobenzoate

Systemtic Name:1,3-thiazol-5-ylmethyl 4-nitrobenzoate
Openeye Name:thiazol-5-ylmethyl 4-nitrobenzoate
CAS Name:4-nitrobenzoic acid 5-thiazolylmethyl ester
IUPAC Name:1,3-thiazol-5-ylmethyl 4-nitrobenzoate
Traditional Name:4-nitrobenzoic acid thiazol-5-ylmethyl ester
Formula: C11H8N2O4S
MolecularWeight: 264.25722
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC2=CN=CS2)[N+](=O)[O-]


Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC2=CN=CS2)[N+](=O)[O-]


InChI

InChI=1S/C11H8N2O4S/c14-11(17-6-10-5-12-7-18-10)8-1-3-9(4-2-8)13(15)16/h1-5,7H,6H2


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