2-(1-phenylprop-2-ynoxycarbonyl)benzoic acid

Systemtic Name: 2-(1-phenylprop-2-ynoxycarbonyl)benzoic acid Openeye Name: 2-(1-phenylprop-2-ynoxycarbonyl)benzoic acid CAS Name: 2-[oxo(1-phenylprop-2-ynoxy)methyl]benzoic acid IUPAC Name: 2-(1-phenylprop-2-ynoxycarbonyl)benzoic acid Traditional Name: 2-(1-phenylprop-2-ynoxycarbonyl)benzoic acid Formula: C17H12O4 MolecularWeight: 280.27478

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Descriptors Computed from Structure

Canonical SMILES:

C#CC(C1=CC=CC=C1)OC(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

C#CC(C1=CC=CC=C1)OC(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C17H12O4/c1-2-15(12-8-4-3-5-9-12)21-17(20)14-11-7-6-10-13(14)16(18)19/h1,3-11,15H,(H,18,19)