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

Systemtic Name: 5-bromanyl-N-[3-chloranyl-4-(4-ethanoylpiperazin-1-yl)phenyl]-2-methoxy-3-methyl-benzamide Openeye Name: N-[4-(4-acetylpiperazin-1-yl)-3-chloro-phenyl]-5-bromo-2-methoxy-3-methyl-benzamide CAS Name: N-[4-(4-acetyl-1-piperazinyl)-3-chlorophenyl]-5-bromo-2-methoxy-3-methylbenzamide IUPAC Name: N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-5-bromo-2-methoxy-3-methylbenzamide Traditional Name: N-[4-(4-acetylpiperazino)-3-chloro-phenyl]-5-bromo-2-methoxy-3-methyl-benzamide Formula: C21H23BrClN3O3 MolecularWeight: 480.78262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C)Cl)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C)Cl)OC

InChI

InChI=1S/C21H23BrClN3O3/c1-13-10-15(22)11-17(20(13)29-3)21(28)24-16-4-5-19(18(23)12-16)26-8-6-25(7-9-26)14(2)27/h4-5,10-12H,6-9H2,1-3H3,(H,24,28)