[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (3R)-3-acetamido-3-phenyl-propanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (3R)-3-acetamido-3-phenyl-propanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (3R)-3-acetamido-3-phenyl-propanoate CAS Name: (3R)-3-acetamido-3-phenylpropanoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (3R)-3-acetamido-3-phenylpropanoate Traditional Name: (3R)-3-acetamido-3-phenyl-propionic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)N[C@H](CC(=O)OCC(=O)NCC#C)C1=CC=CC=C1

InChI

InChI=1S/C16H18N2O4/c1-3-9-17-15(20)11-22-16(21)10-14(18-12(2)19)13-7-5-4-6-8-13/h1,4-8,14H,9-11H2,2H3,(H,17,20)(H,18,19)/t14-/m1/s1