5-methyl-2-(prop-2-ynoylamino)benzoic acid

Systemtic Name: 5-methyl-2-(prop-2-ynoylamino)benzoic acid Openeye Name: 5-methyl-2-(prop-2-ynoylamino)benzoic acid CAS Name: 5-methyl-2-(1-oxoprop-2-ynylamino)benzoic acid IUPAC Name: 5-methyl-2-(prop-2-ynoylamino)benzoic acid Traditional Name: 5-methyl-2-(propioloylamino)benzoic acid Formula: C11H9NO3 MolecularWeight: 203.19406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9NO3/c1-3-10(13)12-9-5-4-7(2)6-8(9)11(14)15/h1,4-6H,2H3,(H,12,13)(H,14,15)