2-[3-[3-(benzimidazol-1-yl)propylamino]-2-oxidanyl-propoxy]pyridine-3-carboxylic acid

Systemtic Name: 2-[3-[3-(benzimidazol-1-yl)propylamino]-2-oxidanyl-propoxy]pyridine-3-carboxylic acid Openeye Name: 2-[3-[3-(benzimidazol-1-yl)propylamino]-2-hydroxy-propoxy]pyridine-3-carboxylic acid CAS Name: 2-[3-[3-(1-benzimidazolyl)propylamino]-2-hydroxypropoxy]-3-pyridinecarboxylic acid IUPAC Name: 2-[3-[3-(benzimidazol-1-yl)propylamino]-2-hydroxypropoxy]pyridine-3-carboxylic acid Traditional Name: 2-[3-[3-(benzimidazol-1-yl)propylamino]-2-hydroxy-propoxy]nicotinic acid Formula: C19H22N4O4 MolecularWeight: 370.40238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2CCCNCC(COC3=C(C=CC=N3)C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2CCCNCC(COC3=C(C=CC=N3)C(=O)O)O

InChI

InChI=1S/C19H22N4O4/c24-14(12-27-18-15(19(25)26)5-3-9-21-18)11-20-8-4-10-23-13-22-16-6-1-2-7-17(16)23/h1-3,5-7,9,13-14,20,24H,4,8,10-12H2,(H,25,26)