diethyl 5-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetyl]amino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C22H23NO7S MolecularWeight: 445.48552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=O)CSC2=CC3=C(C=C2)OCCO3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=O)CSC2=CC3=C(C=C2)OCCO3)C(=O)OCC

InChI

InChI=1S/C22H23NO7S/c1-3-27-21(25)14-9-15(22(26)28-4-2)11-16(10-14)23-20(24)13-31-17-5-6-18-19(12-17)30-8-7-29-18/h5-6,9-12H,3-4,7-8,13H2,1-2H3,(H,23,24)