[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3,4-diethoxybenzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3,4-diethoxybenzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3,4-diethoxybenzoate CAS Name: 3,4-diethoxybenzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3,4-diethoxybenzoate Traditional Name: 3,4-diethoxybenzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C16H19NO5 MolecularWeight: 305.32576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OCC(=O)NCC#C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)OCC(=O)NCC#C)OCC

InChI

InChI=1S/C16H19NO5/c1-4-9-17-15(18)11-22-16(19)12-7-8-13(20-5-2)14(10-12)21-6-3/h1,7-8,10H,5-6,9,11H2,2-3H3,(H,17,18)