ethyl 2-[(2S)-1-[2-(3-methylbutoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[(2S)-1-[2-(3-methylbutoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: ethyl 2-[(2S)-1-(2-isopentyloxybenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[(2S)-1-[[2-(3-methylbutoxy)phenyl]-oxomethyl]-3-oxo-2-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2S)-1-[2-(3-methylbutoxy)benzoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[(2S)-1-(2-isoamoxybenzoyl)-3-keto-piperazin-2-yl]acetic acid ethyl ester Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=CC=C2OCCC(C)C

Isomeric SMILES

CCOC(=O)C[C@H]1C(=O)NCCN1C(=O)C2=CC=CC=C2OCCC(C)C

InChI

InChI=1S/C20H28N2O5/c1-4-26-18(23)13-16-19(24)21-10-11-22(16)20(25)15-7-5-6-8-17(15)27-12-9-14(2)3/h5-8,14,16H,4,9-13H2,1-3H3,(H,21,24)/t16-/m0/s1