butan-2-yl 2-[3-oxidanylidene-1-[2-(4-phenylphenoxy)butanoyl]piperazin-2-yl]ethanoate

Systemtic Name: butan-2-yl 2-[3-oxidanylidene-1-[2-(4-phenylphenoxy)butanoyl]piperazin-2-yl]ethanoate Openeye Name: sec-butyl 2-[3-oxo-1-[2-(4-phenylphenoxy)butanoyl]piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[1-oxo-2-(4-phenylphenoxy)butyl]-2-piperazinyl]acetic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-[3-oxo-1-[2-(4-phenylphenoxy)butanoyl]piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[2-(4-phenylphenoxy)butanoyl]piperazin-2-yl]acetic acid sec-butyl ester Formula: C26H32N2O5 MolecularWeight: 452.54268

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)CC1C(=O)NCCN1C(=O)C(CC)OC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CCC(C)OC(=O)CC1C(=O)NCCN1C(=O)C(CC)OC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H32N2O5/c1-4-18(3)32-24(29)17-22-25(30)27-15-16-28(22)26(31)23(5-2)33-21-13-11-20(12-14-21)19-9-7-6-8-10-19/h6-14,18,22-23H,4-5,15-17H2,1-3H3,(H,27,30)