methyl 3-(1,3-benzodioxol-5-ylcarbonylamino)-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-(1,3-benzodioxol-5-ylcarbonylamino)-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-(1,3-benzodioxole-5-carbonylamino)benzothiophene-2-carboxylate CAS Name: 3-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-(1,3-benzodioxole-5-carbonylamino)-1-benzothiophene-2-carboxylate Traditional Name: 3-(piperonyloylamino)benzothiophene-2-carboxylic acid methyl ester Formula: C18H13NO5S MolecularWeight: 355.36452

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H13NO5S/c1-22-18(21)16-15(11-4-2-3-5-14(11)25-16)19-17(20)10-6-7-12-13(8-10)24-9-23-12/h2-8H,9H2,1H3,(H,19,20)