[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-methoxy-4-methyl-benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-methoxy-4-methyl-benzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-methoxy-4-methyl-benzoate CAS Name: 3-methoxy-4-methylbenzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-methoxy-4-methylbenzoate Traditional Name: 3-methoxy-4-methyl-benzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C14H15NO4 MolecularWeight: 261.2732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)NCC#C)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)NCC#C)OC

InChI

InChI=1S/C14H15NO4/c1-4-7-15-13(16)9-19-14(17)11-6-5-10(2)12(8-11)18-3/h1,5-6,8H,7,9H2,2-3H3,(H,15,16)