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

Systemtic Name: (2-methyl-1,3-thiazol-4-yl)methyl 2-chloranyl-4-nitro-benzoate Openeye Name: (2-methylthiazol-4-yl)methyl 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid (2-methyl-4-thiazolyl)methyl ester IUPAC Name: (2-methyl-1,3-thiazol-4-yl)methyl 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid (2-methylthiazol-4-yl)methyl ester Formula: C12H9ClN2O4S MolecularWeight: 312.72886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)COC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=NC(=CS1)COC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H9ClN2O4S/c1-7-14-8(6-20-7)5-19-12(16)10-3-2-9(15(17)18)4-11(10)13/h2-4,6H,5H2,1H3