[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-[(2-methylphenyl)carbonylamino]propanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-[(2-methylphenyl)carbonylamino]propanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-[(2-methylbenzoyl)amino]propanoate CAS Name: 3-[[(2-methylphenyl)-oxomethyl]amino]propanoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-[(2-methylbenzoyl)amino]propanoate Traditional Name: 3-(o-toluoylamino)propionic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCCC(=O)OCC(=O)NCC#C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCCC(=O)OCC(=O)NCC#C

InChI

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