3-(1,3-benzodioxol-5-ylcarbonylamino)-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-(1,3-benzodioxol-5-ylcarbonylamino)-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-(1,3-benzodioxole-5-carbonylamino)-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-(1,3-benzodioxole-5-carbonylamino)-5-phenylthiophene-2-carboxylic acid Traditional Name: 5-phenyl-3-(piperonyloylamino)-2-thenoic acid Formula: C19H13NO5S MolecularWeight: 367.37522

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=C(SC(=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=C(SC(=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C19H13NO5S/c21-18(12-6-7-14-15(8-12)25-10-24-14)20-13-9-16(26-17(13)19(22)23)11-4-2-1-3-5-11/h1-9H,10H2,(H,20,21)(H,22,23)