methyl 3-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophen-2-yl]carbonylamino]-4-fluoranyl-benzoate

Systemtic Name: methyl 3-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophen-2-yl]carbonylamino]-4-fluoranyl-benzoate Openeye Name: methyl 3-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophene-2-carbonyl]amino]-4-fluoro-benzoate CAS Name: 3-[[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-thiophenyl]-oxomethyl]amino]-4-fluorobenzoic acid methyl ester IUPAC Name: methyl 3-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophene-2-carbonyl]amino]-4-fluorobenzoate Traditional Name: 3-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophene-2-carbonyl]amino]-4-fluoro-benzoic acid methyl ester Formula: C21H16FNO5S MolecularWeight: 413.418843

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)F)NC(=O)C2=CC=C(S2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)F)NC(=O)C2=CC=C(S2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H16FNO5S/c1-26-21(25)13-2-4-14(22)15(10-13)23-20(24)19-7-6-18(29-19)12-3-5-16-17(11-12)28-9-8-27-16/h2-7,10-11H,8-9H2,1H3,(H,23,24)