5-phenyl-4H-1,3-benzodioxole-5-carboxylic acid

Systemtic Name: 5-phenyl-4H-1,3-benzodioxole-5-carboxylic acid Openeye Name: 5-phenyl-4H-1,3-benzodioxole-5-carboxylic acid CAS Name: 5-phenyl-4H-1,3-benzodioxole-5-carboxylic acid IUPAC Name: 5-phenyl-4H-1,3-benzodioxole-5-carboxylic acid Traditional Name: 5-phenyl-4H-1,3-benzodioxole-5-carboxylic acid Formula: C14H12O4 MolecularWeight: 244.24268

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC1(C3=CC=CC=C3)C(=O)O)OCO2

Isomeric SMILES

C1C2=C(C=CC1(C3=CC=CC=C3)C(=O)O)OCO2

InChI

InChI=1S/C14H12O4/c15-13(16)14(10-4-2-1-3-5-10)7-6-11-12(8-14)18-9-17-11/h1-7H,8-9H2,(H,15,16)