2-(2-bromanyl-4,6-dimethyl-phenoxy)-N-[3-chloranyl-2-(4-propanoylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-(2-bromanyl-4,6-dimethyl-phenoxy)-N-[3-chloranyl-2-(4-propanoylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-(2-bromo-4,6-dimethyl-phenoxy)-N-[3-chloro-2-(4-propanoylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-(2-bromo-4,6-dimethylphenoxy)-N-[3-chloro-2-[4-(1-oxopropyl)-1-piperazinyl]phenyl]acetamide IUPAC Name: 2-(2-bromo-4,6-dimethylphenoxy)-N-[3-chloro-2-(4-propanoylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-(2-bromo-4,6-dimethyl-phenoxy)-N-[3-chloro-2-(4-propionylpiperazino)phenyl]acetamide Formula: C23H27BrClN3O3 MolecularWeight: 508.83578

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)COC3=C(C=C(C=C3Br)C)C

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)COC3=C(C=C(C=C3Br)C)C

InChI

InChI=1S/C23H27BrClN3O3/c1-4-21(30)27-8-10-28(11-9-27)22-18(25)6-5-7-19(22)26-20(29)14-31-23-16(3)12-15(2)13-17(23)24/h5-7,12-13H,4,8-11,14H2,1-3H3,(H,26,29)