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

Systemtic Name: 2-[5-[6-(6-phenylmethoxy-1,3-benzoxazol-2-yl)naphthalen-2-yl]oxypentyl]propanedioic acid Openeye Name: 2-[5-[[6-(6-benzyloxy-1,3-benzoxazol-2-yl)-2-naphthyl]oxy]pentyl]propanedioic acid CAS Name: 2-[5-[[6-(6-phenylmethoxy-1,3-benzoxazol-2-yl)-2-naphthalenyl]oxy]pentyl]propanedioic acid IUPAC Name: 2-[5-[6-(6-phenylmethoxy-1,3-benzoxazol-2-yl)naphthalen-2-yl]oxypentyl]propanedioic acid Traditional Name: 2-[5-[6-(6-benzoxy-1,3-benzoxazol-2-yl)-2-naphthoxy]pentyl]malonic acid Formula: C32H29NO7 MolecularWeight: 539.57516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC3=C(C=C2)N=C(O3)C4=CC5=C(C=C4)C=C(C=C5)OCCCCCC(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC3=C(C=C2)N=C(O3)C4=CC5=C(C=C4)C=C(C=C5)OCCCCCC(C(=O)O)C(=O)O

InChI

InChI=1S/C32H29NO7/c34-31(35)27(32(36)37)9-5-2-6-16-38-25-13-12-22-17-24(11-10-23(22)18-25)30-33-28-15-14-26(19-29(28)40-30)39-20-21-7-3-1-4-8-21/h1,3-4,7-8,10-15,17-19,27H,2,5-6,9,16,20H2,(H,34,35)(H,36,37)