butan-2-yl 2-[1-[2-(3,5-dimethylphenoxy)ethanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: butan-2-yl 2-[1-[2-(3,5-dimethylphenoxy)ethanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: sec-butyl 2-[1-[2-(3,5-dimethylphenoxy)acetyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[2-(3,5-dimethylphenoxy)-1-oxoethyl]-3-oxo-2-piperazinyl]acetic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-[1-[2-(3,5-dimethylphenoxy)acetyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[2-(3,5-dimethylphenoxy)acetyl]-3-keto-piperazin-2-yl]acetic acid sec-butyl ester Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N2O5/c1-5-15(4)27-19(24)11-17-20(25)21-6-7-22(17)18(23)12-26-16-9-13(2)8-14(3)10-16/h8-10,15,17H,5-7,11-12H2,1-4H3,(H,21,25)