2-[4-(3-bromanyl-4-methoxy-phenyl)carbonylpiperazin-1-yl]-N-butyl-ethanamide

Systemtic Name: 2-[4-(3-bromanyl-4-methoxy-phenyl)carbonylpiperazin-1-yl]-N-butyl-ethanamide Openeye Name: 2-[4-(3-bromo-4-methoxy-benzoyl)piperazin-1-yl]-N-butyl-acetamide CAS Name: 2-[4-[(3-bromo-4-methoxyphenyl)-oxomethyl]-1-piperazinyl]-N-butylacetamide IUPAC Name: 2-[4-(3-bromo-4-methoxybenzoyl)piperazin-1-yl]-N-butylacetamide Traditional Name: 2-[4-(3-bromo-4-methoxy-benzoyl)piperazino]-N-butyl-acetamide Formula: C18H26BrN3O3 MolecularWeight: 412.32134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C18H26BrN3O3/c1-3-4-7-20-17(23)13-21-8-10-22(11-9-21)18(24)14-5-6-16(25-2)15(19)12-14/h5-6,12H,3-4,7-11,13H2,1-2H3,(H,20,23)