(phenylmethyl) 2-[(2-methoxy-2-oxidanylidene-ethyl)amino]but-3-ynoate

Systemtic Name: (phenylmethyl) 2-[(2-methoxy-2-oxidanylidene-ethyl)amino]but-3-ynoate Openeye Name: benzyl 2-[(2-methoxy-2-oxo-ethyl)amino]but-3-ynoate CAS Name: 2-[(2-methoxy-2-oxoethyl)amino]-3-butynoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(2-methoxy-2-oxoethyl)amino]but-3-ynoate Traditional Name: 2-[(2-keto-2-methoxy-ethyl)amino]but-3-ynoic acid benzyl ester Formula: C14H15NO4 MolecularWeight: 261.2732

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(C#C)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

COC(=O)CNC(C#C)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C14H15NO4/c1-3-12(15-9-13(16)18-2)14(17)19-10-11-7-5-4-6-8-11/h1,4-8,12,15H,9-10H2,2H3