2-[4-(3-bromanyl-2,5-dimethoxy-phenyl)carbonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-(3-bromanyl-2,5-dimethoxy-phenyl)carbonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-(3-bromo-2,5-dimethoxy-benzoyl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[(3-bromo-2,5-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-(3-bromo-2,5-dimethoxybenzoyl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-(3-bromo-2,5-dimethoxy-benzoyl)piperazino]-1-pyrrolidino-ethanone Formula: C19H26BrN3O4 MolecularWeight: 440.33144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)C(=O)N2CCN(CC2)CC(=O)N3CCCC3)OC)Br

Isomeric SMILES

COC1=CC(=C(C(=C1)C(=O)N2CCN(CC2)CC(=O)N3CCCC3)OC)Br

InChI

InChI=1S/C19H26BrN3O4/c1-26-14-11-15(18(27-2)16(20)12-14)19(25)23-9-7-21(8-10-23)13-17(24)22-5-3-4-6-22/h11-12H,3-10,13H2,1-2H3