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

Systemtic Name: butan-2-yl 2-[1-[2-(2,5-dimethylphenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: sec-butyl 2-[1-[2-(2,5-dimethylphenoxy)propanoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[2-(2,5-dimethylphenoxy)-1-oxopropyl]-3-oxo-2-piperazinyl]acetic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-[1-[2-(2,5-dimethylphenoxy)propanoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[2-(2,5-dimethylphenoxy)propanoyl]-3-keto-piperazin-2-yl]acetic acid sec-butyl ester Formula: C21H30N2O5 MolecularWeight: 390.4733

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N2O5/c1-6-15(4)27-19(24)12-17-20(25)22-9-10-23(17)21(26)16(5)28-18-11-13(2)7-8-14(18)3/h7-8,11,15-17H,6,9-10,12H2,1-5H3,(H,22,25)