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

Systemtic Name: 1-(4-bromanyl-2-phenylmethoxy-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-(2-benzyloxy-4-bromo-phenyl)ethane-1,2-dione CAS Name: 1-[(2R)-4-benzoyl-2-methyl-1-piperazinyl]-2-(4-bromo-2-phenylmethoxyphenyl)ethane-1,2-dione IUPAC Name: 1-[(2R)-4-benzoyl-2-methylpiperazin-1-yl]-2-(4-bromo-2-phenylmethoxyphenyl)ethane-1,2-dione Traditional Name: 1-(2-benzoxy-4-bromo-phenyl)-2-[(2R)-4-benzoyl-2-methyl-piperazino]ethane-1,2-dione Formula: C27H25BrN2O4 MolecularWeight: 521.4024

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C(=O)C2=C(C=C(C=C2)Br)OCC3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CN(CCN1C(=O)C(=O)C2=C(C=C(C=C2)Br)OCC3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H25BrN2O4/c1-19-17-29(26(32)21-10-6-3-7-11-21)14-15-30(19)27(33)25(31)23-13-12-22(28)16-24(23)34-18-20-8-4-2-5-9-20/h2-13,16,19H,14-15,17-18H2,1H3/t19-/m1/s1