[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 4-acetamidobenzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 4-acetamidobenzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 4-acetamidobenzoate CAS Name: 4-acetamidobenzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 4-acetamidobenzoate Traditional Name: 4-acetamidobenzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)OCC(=O)NCC#C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)OCC(=O)NCC#C

InChI

InChI=1S/C14H14N2O4/c1-3-8-15-13(18)9-20-14(19)11-4-6-12(7-5-11)16-10(2)17/h1,4-7H,8-9H2,2H3,(H,15,18)(H,16,17)