4-phenyl-2-sulfanyl-naphthalene-1,8-dicarboxylic acid

Systemtic Name: 4-phenyl-2-sulfanyl-naphthalene-1,8-dicarboxylic acid Openeye Name: 4-phenyl-2-sulfanyl-naphthalene-1,8-dicarboxylic acid CAS Name: 2-mercapto-4-phenylnaphthalene-1,8-dicarboxylic acid IUPAC Name: 4-phenyl-2-sulfanylnaphthalene-1,8-dicarboxylic acid Traditional Name: 2-mercapto-4-phenyl-naphthalic acid Formula: C18H12O4S MolecularWeight: 324.35048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(C3=C2C=CC=C3C(=O)O)C(=O)O)S

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(C3=C2C=CC=C3C(=O)O)C(=O)O)S

InChI

InChI=1S/C18H12O4S/c19-17(20)12-8-4-7-11-13(10-5-2-1-3-6-10)9-14(23)16(15(11)12)18(21)22/h1-9,23H,(H,19,20)(H,21,22)