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4-[3-(1H-benzimidazol-2-ylamino)propoxy]benzoic acid

4-[3-(1H-benzimidazol-2-ylamino)propoxy]benzoic acid

Systemtic Name:4-[3-(1H-benzimidazol-2-ylamino)propoxy]benzoic acid
Openeye Name:4-[3-(1H-benzimidazol-2-ylamino)propoxy]benzoic acid
CAS Name:4-[3-(1H-benzimidazol-2-ylamino)propoxy]benzoic acid
IUPAC Name:4-[3-(1H-benzimidazol-2-ylamino)propoxy]benzoic acid
Traditional Name:4-[3-(1H-benzimidazol-2-ylamino)propoxy]benzoic acid
Formula: C17H17N3O3
MolecularWeight: 311.33518
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)NCCCOC3=CC=C(C=C3)C(=O)O


Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)NCCCOC3=CC=C(C=C3)C(=O)O


InChI

InChI=1S/C17H17N3O3/c21-16(22)12-6-8-13(9-7-12)23-11-3-10-18-17-19-14-4-1-2-5-15(14)20-17/h1-2,4-9H,3,10-11H2,(H,21,22)(H2,18,19,20)


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