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

Systemtic Name: disodium 2-[5-[6-(6-phenylmethoxy-1,3-benzoxazol-2-yl)naphthalen-2-yl]oxypentyl]propanedioate Openeye Name: disodium 2-[5-[[6-(6-benzyloxy-1,3-benzoxazol-2-yl)-2-naphthyl]oxy]pentyl]propanedioate CAS Name: disodium 2-[5-[[6-(6-phenylmethoxy-1,3-benzoxazol-2-yl)-2-naphthalenyl]oxy]pentyl]propanedioate IUPAC Name: disodium 2-[5-[6-(6-phenylmethoxy-1,3-benzoxazol-2-yl)naphthalen-2-yl]oxypentyl]propanedioate Traditional Name: disodium 2-[5-[6-(6-benzoxy-1,3-benzoxazol-2-yl)-2-naphthoxy]pentyl]malonate Formula: C32H27NNa2O7 MolecularWeight: 583.53882

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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-].[Na+].[Na+]

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-].[Na+].[Na+]

InChI

InChI=1S/C32H29NO7.2Na/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);;/q;2*+1/p-2