2-(2-phenylethynyl)naphthalene-1,6-dicarboxylic acid

Systemtic Name: 2-(2-phenylethynyl)naphthalene-1,6-dicarboxylic acid Openeye Name: 2-(2-phenylethynyl)naphthalene-1,6-dicarboxylic acid CAS Name: 2-(2-phenylethynyl)naphthalene-1,6-dicarboxylic acid IUPAC Name: 2-(2-phenylethynyl)naphthalene-1,6-dicarboxylic acid Traditional Name: 2-(2-phenylethynyl)naphthalene-1,6-dicarboxylic acid Formula: C20H12O4 MolecularWeight: 316.30688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=C(C3=C(C=C2)C=C(C=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=C(C3=C(C=C2)C=C(C=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C20H12O4/c21-19(22)16-10-11-17-15(12-16)9-8-14(18(17)20(23)24)7-6-13-4-2-1-3-5-13/h1-5,8-12H,(H,21,22)(H,23,24)