4-[2-oxidanylidene-2-(prop-2-ynylamino)ethoxy]benzoate

Systemtic Name: 4-[2-oxidanylidene-2-(prop-2-ynylamino)ethoxy]benzoate Openeye Name: 4-[2-oxo-2-(prop-2-ynylamino)ethoxy]benzoate CAS Name: 4-[2-oxo-2-(prop-2-ynylamino)ethoxy]benzoate IUPAC Name: 4-[2-oxo-2-(prop-2-ynylamino)ethoxy]benzoate Traditional Name: 4-[2-keto-2-(propargylamino)ethoxy]benzoate Formula: C12H10NO4- MolecularWeight: 232.2121

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11NO4/c1-2-7-13-11(14)8-17-10-5-3-9(4-6-10)12(15)16/h1,3-6H,7-8H2,(H,13,14)(H,15,16)/p-1