5-bromanyl-N-[5-chloranyl-2-(4-propanoylpiperazin-1-yl)phenyl]-2-methoxy-3-methyl-benzamide

Systemtic Name: 5-bromanyl-N-[5-chloranyl-2-(4-propanoylpiperazin-1-yl)phenyl]-2-methoxy-3-methyl-benzamide Openeye Name: 5-bromo-N-[5-chloro-2-(4-propanoylpiperazin-1-yl)phenyl]-2-methoxy-3-methyl-benzamide CAS Name: 5-bromo-N-[5-chloro-2-[4-(1-oxopropyl)-1-piperazinyl]phenyl]-2-methoxy-3-methylbenzamide IUPAC Name: 5-bromo-N-[5-chloro-2-(4-propanoylpiperazin-1-yl)phenyl]-2-methoxy-3-methylbenzamide Traditional Name: 5-bromo-N-[5-chloro-2-(4-propionylpiperazino)phenyl]-2-methoxy-3-methyl-benzamide Formula: C22H25BrClN3O3 MolecularWeight: 494.8092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=CC(=CC(=C3OC)C)Br

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=CC(=CC(=C3OC)C)Br

InChI

InChI=1S/C22H25BrClN3O3/c1-4-20(28)27-9-7-26(8-10-27)19-6-5-16(24)13-18(19)25-22(29)17-12-15(23)11-14(2)21(17)30-3/h5-6,11-13H,4,7-10H2,1-3H3,(H,25,29)