3-bromanyl-N-[4-(4-butanoylpiperazin-1-yl)-3-chloranyl-phenyl]-4-ethoxy-benzamide

Systemtic Name: 3-bromanyl-N-[4-(4-butanoylpiperazin-1-yl)-3-chloranyl-phenyl]-4-ethoxy-benzamide Openeye Name: 3-bromo-N-[4-(4-butanoylpiperazin-1-yl)-3-chloro-phenyl]-4-ethoxy-benzamide CAS Name: 3-bromo-N-[3-chloro-4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]-4-ethoxybenzamide IUPAC Name: 3-bromo-N-[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]-4-ethoxybenzamide Traditional Name: 3-bromo-N-[4-(4-butyrylpiperazino)-3-chloro-phenyl]-4-ethoxy-benzamide Formula: C23H27BrClN3O3 MolecularWeight: 508.83578

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)OCC)Br)Cl

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)OCC)Br)Cl

InChI

InChI=1S/C23H27BrClN3O3/c1-3-5-22(29)28-12-10-27(11-13-28)20-8-7-17(15-19(20)25)26-23(30)16-6-9-21(31-4-2)18(24)14-16/h6-9,14-15H,3-5,10-13H2,1-2H3,(H,26,30)