(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl 3-pyrrol-1-ylthiophene-2-carboxylate

Systemtic Name: (6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl 3-pyrrol-1-ylthiophene-2-carboxylate Openeye Name: (6-fluoro-4H-1,3-benzodioxin-8-yl)methyl 3-pyrrol-1-ylthiophene-2-carboxylate CAS Name: 3-(1-pyrrolyl)-2-thiophenecarboxylic acid (6-fluoro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-fluoro-4H-1,3-benzodioxin-8-yl)methyl 3-pyrrol-1-ylthiophene-2-carboxylate Traditional Name: 3-pyrrol-1-ylthiophene-2-carboxylic acid (6-fluoro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C18H14FNO4S MolecularWeight: 359.371463

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=C(C=CS3)N4C=CC=C4)F

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=C(C=CS3)N4C=CC=C4)F

InChI

InChI=1S/C18H14FNO4S/c19-14-7-12-9-22-11-24-16(12)13(8-14)10-23-18(21)17-15(3-6-25-17)20-4-1-2-5-20/h1-8H,9-11H2