2-(1,3-benzodioxol-5-ylcarbonylamino)terephthalic acid

Systemtic Name: 2-(1,3-benzodioxol-5-ylcarbonylamino)terephthalic acid Openeye Name: 2-(1,3-benzodioxole-5-carbonylamino)terephthalic acid CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]terephthalic acid IUPAC Name: 2-(1,3-benzodioxole-5-carbonylamino)terephthalic acid Traditional Name: 2-(piperonyloylamino)terephthalic acid Formula: C16H11NO7 MolecularWeight: 329.26104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11NO7/c18-14(8-2-4-12-13(6-8)24-7-23-12)17-11-5-9(15(19)20)1-3-10(11)16(21)22/h1-6H,7H2,(H,17,18)(H,19,20)(H,21,22)