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5-[2-[4-(3-phenoxypropylamino)butoxy]phenoxy]carbonylpyridine-3-carboxylic acid

5-[2-[4-(3-phenoxypropylamino)butoxy]phenoxy]carbonylpyridine-3-carboxylic acid

Systemtic Name:5-[2-[4-(3-phenoxypropylamino)butoxy]phenoxy]carbonylpyridine-3-carboxylic acid
Openeye Name:5-[2-[4-(3-phenoxypropylamino)butoxy]phenoxy]carbonylpyridine-3-carboxylic acid
CAS Name:5-[oxo-[2-[4-(3-phenoxypropylamino)butoxy]phenoxy]methyl]-3-pyridinecarboxylic acid
IUPAC Name:5-[2-[4-(3-phenoxypropylamino)butoxy]phenoxy]carbonylpyridine-3-carboxylic acid
Traditional Name:5-[2-[4-(3-phenoxypropylamino)butoxy]phenoxy]carbonylnicotinic acid
Formula: C26H28N2O6
MolecularWeight: 464.51032
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCNCCCCOC2=CC=CC=C2OC(=O)C3=CN=CC(=C3)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)OCCCNCCCCOC2=CC=CC=C2OC(=O)C3=CN=CC(=C3)C(=O)O


InChI

InChI=1S/C26H28N2O6/c29-25(30)20-17-21(19-28-18-20)26(31)34-24-12-5-4-11-23(24)33-15-7-6-13-27-14-8-16-32-22-9-2-1-3-10-22/h1-5,9-12,17-19,27H,6-8,13-16H2,(H,29,30)


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