ethyl 2-[(2S)-3-oxidanylidene-1-(4-propoxyphenyl)carbonyl-piperazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[(2S)-3-oxidanylidene-1-(4-propoxyphenyl)carbonyl-piperazin-2-yl]ethanoate Openeye Name: ethyl 2-[(2S)-3-oxo-1-(4-propoxybenzoyl)piperazin-2-yl]acetate CAS Name: 2-[(2S)-3-oxo-1-[oxo-(4-propoxyphenyl)methyl]-2-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2S)-3-oxo-1-(4-propoxybenzoyl)piperazin-2-yl]acetate Traditional Name: 2-[(2S)-3-keto-1-(4-propoxybenzoyl)piperazin-2-yl]acetic acid ethyl ester Formula: C18H24N2O5 MolecularWeight: 348.39356

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)N2CCNC(=O)C2CC(=O)OCC

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)N2CCNC(=O)[C@@H]2CC(=O)OCC

InChI

InChI=1S/C18H24N2O5/c1-3-11-25-14-7-5-13(6-8-14)18(23)20-10-9-19-17(22)15(20)12-16(21)24-4-2/h5-8,15H,3-4,9-12H2,1-2H3,(H,19,22)/t15-/m0/s1