ethyl 2-[(2S)-1-[2-(4-tert-butylphenoxy)ethanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[(2S)-1-[2-(4-tert-butylphenoxy)ethanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: ethyl 2-[(2S)-1-[2-(4-tert-butylphenoxy)acetyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[(2S)-1-[2-(4-tert-butylphenoxy)-1-oxoethyl]-3-oxo-2-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2S)-1-[2-(4-tert-butylphenoxy)acetyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[(2S)-1-[2-(4-tert-butylphenoxy)acetyl]-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)COC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCOC(=O)C[C@H]1C(=O)NCCN1C(=O)COC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C20H28N2O5/c1-5-26-18(24)12-16-19(25)21-10-11-22(16)17(23)13-27-15-8-6-14(7-9-15)20(2,3)4/h6-9,16H,5,10-13H2,1-4H3,(H,21,25)/t16-/m0/s1