2-acetyloxybenzoic acid; 2-methylbut-3-yn-2-amine

Systemtic Name: 2-acetyloxybenzoic acid; 2-methylbut-3-yn-2-amine Openeye Name: 2-acetoxybenzoic acid; 2-methylbut-3-yn-2-amine CAS Name: 2-acetyloxybenzoic acid; 2-methyl-3-butyn-2-amine IUPAC Name: 2-acetyloxybenzoic acid; 2-methylbut-3-yn-2-amine Traditional Name: 2-acetoxybenzoic acid; 1,1-dimethylprop-2-ynylamine Formula: C14H17NO4 MolecularWeight: 263.28908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)O.CC(C)(C#C)N

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)O.CC(C)(C#C)N

InChI

InChI=1S/C9H8O4.C5H9N/c1-6(10)13-8-5-3-2-4-7(8)9(11)12;1-4-5(2,3)6/h2-5H,1H3,(H,11,12);1H,6H2,2-3H3