ethyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-5-phenylthiophene-2-carboxylate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-carbonylamino)-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C22H19NO5S MolecularWeight: 409.45496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H19NO5S/c1-2-26-22(25)20-16(13-19(29-20)14-6-4-3-5-7-14)23-21(24)15-8-9-17-18(12-15)28-11-10-27-17/h3-9,12-13H,2,10-11H2,1H3,(H,23,24)