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

Systemtic Name: dodecyl 2-[1-[2-(4-bromanyl-2-chloranyl-phenoxy)ethanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[1-[2-(4-bromo-2-chloro-phenoxy)acetyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[2-(4-bromo-2-chlorophenoxy)-1-oxoethyl]-3-oxo-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[1-[2-(4-bromo-2-chlorophenoxy)acetyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[2-(4-bromo-2-chloro-phenoxy)acetyl]-3-keto-piperazin-2-yl]acetic acid lauryl ester Formula: C26H38BrClN2O5 MolecularWeight: 573.94732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)COC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)COC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C26H38BrClN2O5/c1-2-3-4-5-6-7-8-9-10-11-16-34-25(32)18-22-26(33)29-14-15-30(22)24(31)19-35-23-13-12-20(27)17-21(23)28/h12-13,17,22H,2-11,14-16,18-19H2,1H3,(H,29,33)