[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-ethoxy-4-propoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-ethoxy-4-propoxy-benzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-ethoxy-4-propoxy-benzoate CAS Name: 3-ethoxy-4-propoxybenzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-ethoxy-4-propoxybenzoate Traditional Name: 3-ethoxy-4-propoxy-benzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)OCC(=O)NCC#C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)OCC(=O)NCC#C)OCC

InChI

InChI=1S/C17H21NO5/c1-4-9-18-16(19)12-23-17(20)13-7-8-14(22-10-5-2)15(11-13)21-6-3/h1,7-8,11H,5-6,9-10,12H2,2-3H3,(H,18,19)