3-(diethanoylamino)-5-(3-oxidanylprop-1-ynyl)benzoic acid

Systemtic Name: 3-(diethanoylamino)-5-(3-oxidanylprop-1-ynyl)benzoic acid Openeye Name: 3-(diacetylamino)-5-(3-hydroxyprop-1-ynyl)benzoic acid CAS Name: 3-(diacetylamino)-5-(3-hydroxyprop-1-ynyl)benzoic acid IUPAC Name: 3-(diacetylamino)-5-(3-hydroxyprop-1-ynyl)benzoic acid Traditional Name: 3-(diacetylamino)-5-(3-hydroxyprop-1-ynyl)benzoic acid Formula: C14H13NO5 MolecularWeight: 275.25672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13NO5/c1-9(17)15(10(2)18)13-7-11(4-3-5-16)6-12(8-13)14(19)20/h6-8,16H,5H2,1-2H3,(H,19,20)