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

Systemtic Name: (2-ethyl-1,3-thiazol-4-yl)methyl 2-chloranyl-4-nitro-benzoate Openeye Name: (2-ethylthiazol-4-yl)methyl 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid (2-ethyl-4-thiazolyl)methyl ester IUPAC Name: (2-ethyl-1,3-thiazol-4-yl)methyl 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid (2-ethylthiazol-4-yl)methyl ester Formula: C13H11ClN2O4S MolecularWeight: 326.75544

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CS1)COC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCC1=NC(=CS1)COC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H11ClN2O4S/c1-2-12-15-8(7-21-12)6-20-13(17)10-4-3-9(16(18)19)5-11(10)14/h3-5,7H,2,6H2,1H3