(phenylmethyl) 3-ethynyl-4-[(2-methoxy-2-oxidanylidene-ethyl)-methyl-amino]benzoate

Systemtic Name: (phenylmethyl) 3-ethynyl-4-[(2-methoxy-2-oxidanylidene-ethyl)-methyl-amino]benzoate Openeye Name: benzyl 3-ethynyl-4-[(2-methoxy-2-oxo-ethyl)-methyl-amino]benzoate CAS Name: 3-ethynyl-4-[(2-methoxy-2-oxoethyl)-methylamino]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-ethynyl-4-[(2-methoxy-2-oxoethyl)-methylamino]benzoate Traditional Name: 3-ethynyl-4-[(2-keto-2-methoxy-ethyl)-methyl-amino]benzoic acid benzyl ester Formula: C20H19NO4 MolecularWeight: 337.36916

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC)C1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2)C#C

Isomeric SMILES

CN(CC(=O)OC)C1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2)C#C

InChI

InChI=1S/C20H19NO4/c1-4-16-12-17(10-11-18(16)21(2)13-19(22)24-3)20(23)25-14-15-8-6-5-7-9-15/h1,5-12H,13-14H2,2-3H3