butan-2-yl 2-[1-[2-(4-chloranylphenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: butan-2-yl 2-[1-[2-(4-chloranylphenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: sec-butyl 2-[1-[2-(4-chlorophenoxy)propanoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[2-(4-chlorophenoxy)-1-oxopropyl]-3-oxo-2-piperazinyl]acetic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-[1-[2-(4-chlorophenoxy)propanoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[2-(4-chlorophenoxy)propanoyl]-3-keto-piperazin-2-yl]acetic acid sec-butyl ester Formula: C19H25ClN2O5 MolecularWeight: 396.8652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25ClN2O5/c1-4-12(2)26-17(23)11-16-18(24)21-9-10-22(16)19(25)13(3)27-15-7-5-14(20)6-8-15/h5-8,12-13,16H,4,9-11H2,1-3H3,(H,21,24)