4-(4-carboxy-3-ethynyl-phenyl)-2-ethynyl-benzoic acid

Systemtic Name: 4-(4-carboxy-3-ethynyl-phenyl)-2-ethynyl-benzoic acid Openeye Name: 4-(4-carboxy-3-ethynyl-phenyl)-2-ethynyl-benzoic acid CAS Name: 4-(4-carboxy-3-ethynylphenyl)-2-ethynylbenzoic acid IUPAC Name: 4-(4-carboxy-3-ethynylphenyl)-2-ethynylbenzoic acid Traditional Name: 4-(4-carboxy-3-ethynyl-phenyl)-2-ethynyl-benzoic acid Formula: C18H10O4 MolecularWeight: 290.2696

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=C(C=CC(=C1)C2=CC(=C(C=C2)C(=O)O)C#C)C(=O)O

Isomeric SMILES

C#CC1=C(C=CC(=C1)C2=CC(=C(C=C2)C(=O)O)C#C)C(=O)O

InChI

InChI=1S/C18H10O4/c1-3-11-9-13(5-7-15(11)17(19)20)14-6-8-16(18(21)22)12(4-2)10-14/h1-2,5-10H,(H,19,20)(H,21,22)