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

Systemtic Name: propan-2-yl 2-[(2S)-1-[2-(4-tert-butylphenoxy)ethanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C21H30N2O5 MolecularWeight: 390.4733

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC1C(=O)NCCN1C(=O)COC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H30N2O5/c1-14(2)28-19(25)12-17-20(26)22-10-11-23(17)18(24)13-27-16-8-6-15(7-9-16)21(3,4)5/h6-9,14,17H,10-13H2,1-5H3,(H,22,26)/t17-/m0/s1