[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-[[(E)-3-phenylprop-2-enoyl]amino]propanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-[[(E)-3-phenylprop-2-enoyl]amino]propanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-[[(E)-3-phenylprop-2-enoyl]amino]propanoate CAS Name: 3-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]propanoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-[[(E)-3-phenylprop-2-enoyl]amino]propanoate Traditional Name: 3-[[(E)-3-phenylacryloyl]amino]propionic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)CCNC(=O)C=CC1=CC=CC=C1

Isomeric SMILES

C#CCNC(=O)COC(=O)CCNC(=O)/C=C/C1=CC=CC=C1

InChI

InChI=1S/C17H18N2O4/c1-2-11-18-16(21)13-23-17(22)10-12-19-15(20)9-8-14-6-4-3-5-7-14/h1,3-9H,10-13H2,(H,18,21)(H,19,20)/b9-8+