2-[5-[6-(1,3-oxazol-2-yl)naphthalen-2-yl]oxypentyl]propanedioic acid

Systemtic Name: 2-[5-[6-(1,3-oxazol-2-yl)naphthalen-2-yl]oxypentyl]propanedioic acid Openeye Name: 2-[5-[(6-oxazol-2-yl-2-naphthyl)oxy]pentyl]propanedioic acid CAS Name: 2-[5-[[6-(2-oxazolyl)-2-naphthalenyl]oxy]pentyl]propanedioic acid IUPAC Name: 2-[5-[6-(1,3-oxazol-2-yl)naphthalen-2-yl]oxypentyl]propanedioic acid Traditional Name: 2-[5-(6-oxazol-2-yl-2-naphthoxy)pentyl]malonic acid Formula: C21H21NO6 MolecularWeight: 383.39454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)OCCCCCC(C(=O)O)C(=O)O)C=C1C3=NC=CO3

Isomeric SMILES

C1=CC2=C(C=CC(=C2)OCCCCCC(C(=O)O)C(=O)O)C=C1C3=NC=CO3

InChI

InChI=1S/C21H21NO6/c23-20(24)18(21(25)26)4-2-1-3-10-27-17-8-7-14-12-16(6-5-15(14)13-17)19-22-9-11-28-19/h5-9,11-13,18H,1-4,10H2,(H,23,24)(H,25,26)