dimethyl 5-[2-(1-benzothiophen-2-ylcarbonyloxy)ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(1-benzothiophen-2-ylcarbonyloxy)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(benzothiophene-2-carbonyloxy)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[1-benzothiophen-2-yl(oxo)methoxy]-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(1-benzothiophene-2-carbonyloxy)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(benzothiophene-2-carbonyloxy)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H17NO7S MolecularWeight: 427.42718

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)COC(=O)C2=CC3=CC=CC=C3S2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)COC(=O)C2=CC3=CC=CC=C3S2)C(=O)OC

InChI

InChI=1S/C21H17NO7S/c1-27-19(24)13-7-14(20(25)28-2)9-15(8-13)22-18(23)11-29-21(26)17-10-12-5-3-4-6-16(12)30-17/h3-10H,11H2,1-2H3,(H,22,23)