4-[4-[4-(4,5-dicarboxynaphthalen-1-yl)sulfanylphenyl]phenyl]sulfanylnaphthalene-1,8-dicarboxylic acid

Systemtic Name: 4-[4-[4-(4,5-dicarboxynaphthalen-1-yl)sulfanylphenyl]phenyl]sulfanylnaphthalene-1,8-dicarboxylic acid Openeye Name: 4-[4-[4-[(4,5-dicarboxy-1-naphthyl)sulfanyl]phenyl]phenyl]sulfanylnaphthalene-1,8-dicarboxylic acid CAS Name: 4-[[4-[4-[(4,5-dicarboxy-1-naphthalenyl)thio]phenyl]phenyl]thio]naphthalene-1,8-dicarboxylic acid IUPAC Name: 4-[4-[4-(4,5-dicarboxynaphthalen-1-yl)sulfanylphenyl]phenyl]sulfanylnaphthalene-1,8-dicarboxylic acid Traditional Name: 4-[[4-[4-[(4,5-dicarboxy-1-naphthyl)thio]phenyl]phenyl]thio]naphthalic acid Formula: C36H22O8S2 MolecularWeight: 646.68508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2C(=C1)C(=O)O)C(=O)O)SC3=CC=C(C=C3)C4=CC=C(C=C4)SC5=C6C=CC=C(C6=C(C=C5)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC2=C(C=CC(=C2C(=C1)C(=O)O)C(=O)O)SC3=CC=C(C=C3)C4=CC=C(C=C4)SC5=C6C=CC=C(C6=C(C=C5)C(=O)O)C(=O)O

InChI

InChI=1S/C36H22O8S2/c37-33(38)25-5-1-3-23-29(17-15-27(31(23)25)35(41)42)45-21-11-7-19(8-12-21)20-9-13-22(14-10-20)46-30-18-16-28(36(43)44)32-24(30)4-2-6-26(32)34(39)40/h1-18H,(H,37,38)(H,39,40)(H,41,42)(H,43,44)