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

Systemtic Name: methyl 2-[3-oxidanylidene-1-(3-phenylprop-2-ynyl)piperazin-2-yl]ethanoate hydrochloride Openeye Name: methyl 2-[3-oxo-1-(3-phenylprop-2-ynyl)piperazin-2-yl]acetate hydrochloride CAS Name: 2-[3-oxo-1-(3-phenylprop-2-ynyl)-2-piperazinyl]acetic acid methyl ester hydrochloride IUPAC Name: methyl 2-[3-oxo-1-(3-phenylprop-2-ynyl)piperazin-2-yl]acetate hydrochloride Traditional Name: 2-[3-keto-1-(3-phenylprop-2-ynyl)piperazin-2-yl]acetic acid methyl ester hydrochloride Formula: C16H19ClN2O3 MolecularWeight: 322.78666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O3.ClH/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);1H