ethyl 4-(4-bromanyl-3,5-dimethoxy-phenyl)carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(4-bromanyl-3,5-dimethoxy-phenyl)carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(4-bromo-3,5-dimethoxy-benzoyl)piperazine-1-carboxylate CAS Name: 4-[(4-bromo-3,5-dimethoxyphenyl)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromo-3,5-dimethoxybenzoyl)piperazine-1-carboxylate Traditional Name: 4-(4-bromo-3,5-dimethoxy-benzoyl)piperazine-1-carboxylic acid ethyl ester Formula: C16H21BrN2O5 MolecularWeight: 401.25234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C(=C2)OC)Br)OC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C(=C2)OC)Br)OC

InChI

InChI=1S/C16H21BrN2O5/c1-4-24-16(21)19-7-5-18(6-8-19)15(20)11-9-12(22-2)14(17)13(10-11)23-3/h9-10H,4-8H2,1-3H3