ethyl 3-nitro-4-(1,3-thiazol-2-yl)benzoate

Systemtic Name: ethyl 3-nitro-4-(1,3-thiazol-2-yl)benzoate Openeye Name: ethyl 3-nitro-4-thiazol-2-yl-benzoate CAS Name: 3-nitro-4-(2-thiazolyl)benzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-4-(1,3-thiazol-2-yl)benzoate Traditional Name: 3-nitro-4-thiazol-2-yl-benzoic acid ethyl ester Formula: C12H10N2O4S MolecularWeight: 278.2838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C2=NC=CS2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C2=NC=CS2)[N+](=O)[O-]

InChI

InChI=1S/C12H10N2O4S/c1-2-18-12(15)8-3-4-9(10(7-8)14(16)17)11-13-5-6-19-11/h3-7H,2H2,1H3