(2-chloranyl-4-nitro-phenyl) 1,3-benzothiazole-6-carboxylate

Systemtic Name: (2-chloranyl-4-nitro-phenyl) 1,3-benzothiazole-6-carboxylate Openeye Name: (2-chloro-4-nitro-phenyl) 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid (2-chloro-4-nitrophenyl) ester IUPAC Name: (2-chloro-4-nitrophenyl) 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid (2-chloro-4-nitro-phenyl) ester Formula: C14H7ClN2O4S MolecularWeight: 334.73438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl)SC=N2

Isomeric SMILES

C1=CC2=C(C=C1C(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl)SC=N2

InChI

InChI=1S/C14H7ClN2O4S/c15-10-6-9(17(19)20)2-4-12(10)21-14(18)8-1-3-11-13(5-8)22-7-16-11/h1-7H