1-(4-bromanyl-2-methoxy-phenyl)-2-[(2R)-2-methyl-4-(phenylcarbonyl)piperazin-1-yl]ethane-1,2-dione

Systemtic Name: 1-(4-bromanyl-2-methoxy-phenyl)-2-[(2R)-2-methyl-4-(phenylcarbonyl)piperazin-1-yl]ethane-1,2-dione Openeye Name: 1-[(2R)-4-benzoyl-2-methyl-piperazin-1-yl]-2-(4-bromo-2-methoxy-phenyl)ethane-1,2-dione CAS Name: 1-[(2R)-4-benzoyl-2-methyl-1-piperazinyl]-2-(4-bromo-2-methoxyphenyl)ethane-1,2-dione IUPAC Name: 1-[(2R)-4-benzoyl-2-methylpiperazin-1-yl]-2-(4-bromo-2-methoxyphenyl)ethane-1,2-dione Traditional Name: 1-[(2R)-4-benzoyl-2-methyl-piperazino]-2-(4-bromo-2-methoxy-phenyl)ethane-1,2-dione Formula: C21H21BrN2O4 MolecularWeight: 445.30644

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C(=O)C2=C(C=C(C=C2)Br)OC)C(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@@H]1CN(CCN1C(=O)C(=O)C2=C(C=C(C=C2)Br)OC)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H21BrN2O4/c1-14-13-23(20(26)15-6-4-3-5-7-15)10-11-24(14)21(27)19(25)17-9-8-16(22)12-18(17)28-2/h3-9,12,14H,10-11,13H2,1-2H3/t14-/m1/s1