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2-(6-octoxypyridin-3-yl)-1,3-benzoxazole-5-carboxylic acid

2-(6-octoxypyridin-3-yl)-1,3-benzoxazole-5-carboxylic acid

Systemtic Name:2-(6-octoxypyridin-3-yl)-1,3-benzoxazole-5-carboxylic acid
Openeye Name:2-(6-octoxy-3-pyridyl)-1,3-benzoxazole-5-carboxylic acid
CAS Name:2-(6-octoxy-3-pyridinyl)-1,3-benzoxazole-5-carboxylic acid
IUPAC Name:2-(6-octoxypyridin-3-yl)-1,3-benzoxazole-5-carboxylic acid
Traditional Name:2-(6-octoxy-3-pyridyl)-1,3-benzoxazole-5-carboxylic acid
Formula: C21H24N2O4
MolecularWeight: 368.42626
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=NC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C(=O)O


Isomeric SMILES

CCCCCCCCOC1=NC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C(=O)O


InChI

InChI=1S/C21H24N2O4/c1-2-3-4-5-6-7-12-26-19-11-9-16(14-22-19)20-23-17-13-15(21(24)25)8-10-18(17)27-20/h8-11,13-14H,2-7,12H2,1H3,(H,24,25)


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