methyl 3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-fluoro-benzothiophene-2-carboxylate CAS Name: 3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-fluoro-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-fluoro-benzothiophene-2-carboxylic acid methyl ester Formula: C17H18FNO6S2 MolecularWeight: 415.456323

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(C=CC=C2S1)F)S(=O)(=O)N3CCC4(CC3)OCCO4

Isomeric SMILES

COC(=O)C1=C(C2=C(C=CC=C2S1)F)S(=O)(=O)N3CCC4(CC3)OCCO4

InChI

InChI=1S/C17H18FNO6S2/c1-23-16(20)14-15(13-11(18)3-2-4-12(13)26-14)27(21,22)19-7-5-17(6-8-19)24-9-10-25-17/h2-4H,5-10H2,1H3