methyl 2-[(2R)-3-oxidanylidene-1-(3-phenylprop-2-ynyl)piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[(2R)-3-oxidanylidene-1-(3-phenylprop-2-ynyl)piperazin-2-yl]ethanoate Openeye Name: methyl 2-[(2R)-3-oxo-1-(3-phenylprop-2-ynyl)piperazin-2-yl]acetate CAS Name: 2-[(2R)-3-oxo-1-(3-phenylprop-2-ynyl)-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[(2R)-3-oxo-1-(3-phenylprop-2-ynyl)piperazin-2-yl]acetate Traditional Name: 2-[(2R)-3-keto-1-(3-phenylprop-2-ynyl)piperazin-2-yl]acetic acid methyl ester Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)NCCN1CC#CC2=CC=CC=C2

Isomeric SMILES

COC(=O)C[C@@H]1C(=O)NCCN1CC#CC2=CC=CC=C2

InChI

InChI=1S/C16H18N2O3/c1-21-15(19)12-14-16(20)17-9-11-18(14)10-5-8-13-6-3-2-4-7-13/h2-4,6-7,14H,9-12H2,1H3,(H,17,20)/t14-/m1/s1