2-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]oxypropanedioic acid

Systemtic Name: 2-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]oxypropanedioic acid Openeye Name: 2-[[6-(1,3-benzoxazol-2-yl)-2-naphthyl]oxy]propanedioic acid CAS Name: 2-[[6-(1,3-benzoxazol-2-yl)-2-naphthalenyl]oxy]propanedioic acid IUPAC Name: 2-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]oxypropanedioic acid Traditional Name: 2-[6-(1,3-benzoxazol-2-yl)-2-naphthoxy]malonic acid Formula: C20H13NO6 MolecularWeight: 363.32032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)C3=CC4=C(C=C3)C=C(C=C4)OC(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)C3=CC4=C(C=C3)C=C(C=C4)OC(C(=O)O)C(=O)O

InChI

InChI=1S/C20H13NO6/c22-19(23)17(20(24)25)26-14-8-7-11-9-13(6-5-12(11)10-14)18-21-15-3-1-2-4-16(15)27-18/h1-10,17H,(H,22,23)(H,24,25)