5-(diethanoylamino)-2-ethynyl-benzoic acid

Systemtic Name: 5-(diethanoylamino)-2-ethynyl-benzoic acid Openeye Name: 5-(diacetylamino)-2-ethynyl-benzoic acid CAS Name: 5-(diacetylamino)-2-ethynylbenzoic acid IUPAC Name: 5-(diacetylamino)-2-ethynylbenzoic acid Traditional Name: 5-(diacetylamino)-2-ethynyl-benzoic acid Formula: C13H11NO4 MolecularWeight: 245.23074

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC(=C(C=C1)C#C)C(=O)O)C(=O)C

Isomeric SMILES

CC(=O)N(C1=CC(=C(C=C1)C#C)C(=O)O)C(=O)C

InChI

InChI=1S/C13H11NO4/c1-4-10-5-6-11(7-12(10)13(17)18)14(8(2)15)9(3)16/h1,5-7H,2-3H3,(H,17,18)