1-(3-bromanylpropyl)-4-[(2,4-dimethoxyphenyl)methyl]piperazine-2,3-dione

Systemtic Name: 1-(3-bromanylpropyl)-4-[(2,4-dimethoxyphenyl)methyl]piperazine-2,3-dione Openeye Name: 1-(3-bromopropyl)-4-[(2,4-dimethoxyphenyl)methyl]piperazine-2,3-dione CAS Name: 1-(3-bromopropyl)-4-[(2,4-dimethoxyphenyl)methyl]piperazine-2,3-dione IUPAC Name: 1-(3-bromopropyl)-4-[(2,4-dimethoxyphenyl)methyl]piperazine-2,3-dione Traditional Name: 1-(3-bromopropyl)-4-(2,4-dimethoxybenzyl)piperazine-2,3-quinone Formula: C16H21BrN2O4 MolecularWeight: 385.25294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2CCN(C(=O)C2=O)CCCBr)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN2CCN(C(=O)C2=O)CCCBr)OC

InChI

InChI=1S/C16H21BrN2O4/c1-22-13-5-4-12(14(10-13)23-2)11-19-9-8-18(7-3-6-17)15(20)16(19)21/h4-5,10H,3,6-9,11H2,1-2H3