2-[4-[2-oxidanylidene-2-(prop-2-ynylamino)ethoxy]phenyl]ethanoate

Systemtic Name: 2-[4-[2-oxidanylidene-2-(prop-2-ynylamino)ethoxy]phenyl]ethanoate Openeye Name: 2-[4-[2-oxo-2-(prop-2-ynylamino)ethoxy]phenyl]acetate CAS Name: 2-[4-[2-oxo-2-(prop-2-ynylamino)ethoxy]phenyl]acetate IUPAC Name: 2-[4-[2-oxo-2-(prop-2-ynylamino)ethoxy]phenyl]acetate Traditional Name: 2-[4-[2-keto-2-(propargylamino)ethoxy]phenyl]acetate Formula: C13H12NO4- MolecularWeight: 246.23868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC1=CC=C(C=C1)CC(=O)[O-]

Isomeric SMILES

C#CCNC(=O)COC1=CC=C(C=C1)CC(=O)[O-]

InChI

InChI=1S/C13H13NO4/c1-2-7-14-12(15)9-18-11-5-3-10(4-6-11)8-13(16)17/h1,3-6H,7-9H2,(H,14,15)(H,16,17)/p-1