2-[4-(1,3-benzodioxol-5-ylcarbonylamino)phenyl]ethanoic acid

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylcarbonylamino)phenyl]ethanoic acid Openeye Name: 2-[4-(1,3-benzodioxole-5-carbonylamino)phenyl]acetic acid CAS Name: 2-[4-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-(1,3-benzodioxole-5-carbonylamino)phenyl]acetic acid Traditional Name: 2-[4-(piperonyloylamino)phenyl]acetic acid Formula: C16H13NO5 MolecularWeight: 299.27812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO5/c18-15(19)7-10-1-4-12(5-2-10)17-16(20)11-3-6-13-14(8-11)22-9-21-13/h1-6,8H,7,9H2,(H,17,20)(H,18,19)