dodecyl 2-[1-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: dodecyl 2-[1-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[1-[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[2-(4-bromo-2,6-dimethylphenoxy)-1-oxoethyl]-3-oxo-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[1-[2-(4-bromo-2,6-dimethylphenoxy)acetyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]-3-keto-piperazin-2-yl]acetic acid lauryl ester Formula: C28H43BrN2O5 MolecularWeight: 567.55542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)COC2=C(C=C(C=C2C)Br)C

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)COC2=C(C=C(C=C2C)Br)C

InChI

InChI=1S/C28H43BrN2O5/c1-4-5-6-7-8-9-10-11-12-13-16-35-26(33)19-24-28(34)30-14-15-31(24)25(32)20-36-27-21(2)17-23(29)18-22(27)3/h17-18,24H,4-16,19-20H2,1-3H3,(H,30,34)