4-[1-[2-(3,4-dicarboxyphenoxy)naphthalen-1-yl]naphthalen-2-yl]oxyphthalic acid

Systemtic Name: 4-[1-[2-(3,4-dicarboxyphenoxy)naphthalen-1-yl]naphthalen-2-yl]oxyphthalic acid Openeye Name: 4-[[1-[2-(3,4-dicarboxyphenoxy)-1-naphthyl]-2-naphthyl]oxy]phthalic acid CAS Name: 4-[[1-[2-(3,4-dicarboxyphenoxy)-1-naphthalenyl]-2-naphthalenyl]oxy]phthalic acid IUPAC Name: 4-[1-[2-(3,4-dicarboxyphenoxy)naphthalen-1-yl]naphthalen-2-yl]oxyphthalic acid Traditional Name: 4-[1-[2-(3,4-dicarboxyphenoxy)-1-naphthyl]-2-naphthoxy]phthalic acid Formula: C36H22O10 MolecularWeight: 614.55388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)OC5=CC(=C(C=C5)C(=O)O)C(=O)O)OC6=CC(=C(C=C6)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)OC5=CC(=C(C=C5)C(=O)O)C(=O)O)OC6=CC(=C(C=C6)C(=O)O)C(=O)O

InChI

InChI=1S/C36H22O10/c37-33(38)25-13-11-21(17-27(25)35(41)42)45-29-15-9-19-5-1-3-7-23(19)31(29)32-24-8-4-2-6-20(24)10-16-30(32)46-22-12-14-26(34(39)40)28(18-22)36(43)44/h1-18H,(H,37,38)(H,39,40)(H,41,42)(H,43,44)