1-(5-azanyl-4-fluoranyl-1,3-benzothiazol-2-yl)but-3-enyl hydrogen carbonate

Systemtic Name: 1-(5-azanyl-4-fluoranyl-1,3-benzothiazol-2-yl)but-3-enyl hydrogen carbonate Openeye Name: 1-(5-amino-4-fluoro-1,3-benzothiazol-2-yl)but-3-enyl hydrogen carbonate CAS Name: carbonic acid 1-(5-amino-4-fluoro-1,3-benzothiazol-2-yl)but-3-enyl ester IUPAC Name: 1-(5-amino-4-fluoro-1,3-benzothiazol-2-yl)but-3-enyl hydrogen carbonate Traditional Name: carbonic acid 1-(5-amino-4-fluoro-1,3-benzothiazol-2-yl)but-3-enyl ester Formula: C12H11FN2O3S MolecularWeight: 282.290743

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C1=NC2=C(S1)C=CC(=C2F)N)OC(=O)O

Isomeric SMILES

C=CCC(C1=NC2=C(S1)C=CC(=C2F)N)OC(=O)O

InChI

InChI=1S/C12H11FN2O3S/c1-2-3-7(18-12(16)17)11-15-10-8(19-11)5-4-6(14)9(10)13/h2,4-5,7H,1,3,14H2,(H,16,17)