2-[2-(1,3-benzodioxol-5-yl)benzimidazol-1-yl]ethanoic acid

Systemtic Name: 2-[2-(1,3-benzodioxol-5-yl)benzimidazol-1-yl]ethanoic acid Openeye Name: 2-[2-(1,3-benzodioxol-5-yl)benzimidazol-1-yl]acetic acid CAS Name: 2-[2-(1,3-benzodioxol-5-yl)-1-benzimidazolyl]acetic acid IUPAC Name: 2-[2-(1,3-benzodioxol-5-yl)benzimidazol-1-yl]acetic acid Traditional Name: 2-[2-(1,3-benzodioxol-5-yl)benzimidazol-1-yl]acetic acid Formula: C16H12N2O4 MolecularWeight: 296.27748

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4N3CC(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4N3CC(=O)O

InChI

InChI=1S/C16H12N2O4/c19-15(20)8-18-12-4-2-1-3-11(12)17-16(18)10-5-6-13-14(7-10)22-9-21-13/h1-7H,8-9H2,(H,19,20)