[3-(tert-butylamino)-3-oxidanylidene-2-phenyl-propyl] prop-2-ynoate

Systemtic Name: [3-(tert-butylamino)-3-oxidanylidene-2-phenyl-propyl] prop-2-ynoate Openeye Name: [3-(tert-butylamino)-3-oxo-2-phenyl-propyl] prop-2-ynoate CAS Name: 2-propynoic acid [3-(tert-butylamino)-3-oxo-2-phenylpropyl] ester IUPAC Name: [3-(tert-butylamino)-3-oxo-2-phenylpropyl] prop-2-ynoate Traditional Name: propiolic acid [3-(tert-butylamino)-3-keto-2-phenyl-propyl] ester Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(COC(=O)C#C)C1=CC=CC=C1

Isomeric SMILES

CC(C)(C)NC(=O)C(COC(=O)C#C)C1=CC=CC=C1

InChI

InChI=1S/C16H19NO3/c1-5-14(18)20-11-13(12-9-7-6-8-10-12)15(19)17-16(2,3)4/h1,6-10,13H,11H2,2-4H3,(H,17,19)