propan-2-yl 3-chloranyl-6-nitro-1-benzothiophene-2-carboxylate

Systemtic Name: propan-2-yl 3-chloranyl-6-nitro-1-benzothiophene-2-carboxylate Openeye Name: isopropyl 3-chloro-6-nitro-benzothiophene-2-carboxylate CAS Name: 3-chloro-6-nitro-1-benzothiophene-2-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-chloro-6-nitro-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-nitro-benzothiophene-2-carboxylic acid isopropyl ester Formula: C12H10ClNO4S MolecularWeight: 299.7301

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(C2=C(S1)C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)OC(=O)C1=C(C2=C(S1)C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H10ClNO4S/c1-6(2)18-12(15)11-10(13)8-4-3-7(14(16)17)5-9(8)19-11/h3-6H,1-2H3