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3-[3-(benzimidazol-1-yl)-2-oxidanyl-propoxy]benzoic acid

3-[3-(benzimidazol-1-yl)-2-oxidanyl-propoxy]benzoic acid

Systemtic Name:3-[3-(benzimidazol-1-yl)-2-oxidanyl-propoxy]benzoic acid
Openeye Name:3-[3-(benzimidazol-1-yl)-2-hydroxy-propoxy]benzoic acid
CAS Name:3-[3-(1-benzimidazolyl)-2-hydroxypropoxy]benzoic acid
IUPAC Name:3-[3-(benzimidazol-1-yl)-2-hydroxypropoxy]benzoic acid
Traditional Name:3-[3-(benzimidazol-1-yl)-2-hydroxy-propoxy]benzoic acid
Formula: C17H16N2O4
MolecularWeight: 312.31994
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2CC(COC3=CC=CC(=C3)C(=O)O)O


Isomeric SMILES

C1=CC=C2C(=C1)N=CN2CC(COC3=CC=CC(=C3)C(=O)O)O


InChI

InChI=1S/C17H16N2O4/c20-13(9-19-11-18-15-6-1-2-7-16(15)19)10-23-14-5-3-4-12(8-14)17(21)22/h1-8,11,13,20H,9-10H2,(H,21,22)


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