[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-(2-methylpropoxy)benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-(2-methylpropoxy)benzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-isobutoxybenzoate CAS Name: 3-(2-methylpropoxy)benzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-(2-methylpropoxy)benzoate Traditional Name: 3-isobutoxybenzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C(=O)OCC(=O)NCC#C

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C(=O)OCC(=O)NCC#C

InChI

InChI=1S/C16H19NO4/c1-4-8-17-15(18)11-21-16(19)13-6-5-7-14(9-13)20-10-12(2)3/h1,5-7,9,12H,8,10-11H2,2-3H3,(H,17,18)