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

Systemtic Name: 1-(2-azanyl-4-bromanyl-phenyl)-2-[(2R)-2-methyl-4-(phenylcarbonyl)piperazin-1-yl]ethane-1,2-dione Openeye Name: 1-(2-amino-4-bromo-phenyl)-2-[(2R)-4-benzoyl-2-methyl-piperazin-1-yl]ethane-1,2-dione CAS Name: 1-(2-amino-4-bromophenyl)-2-[(2R)-4-benzoyl-2-methyl-1-piperazinyl]ethane-1,2-dione IUPAC Name: 1-(2-amino-4-bromophenyl)-2-[(2R)-4-benzoyl-2-methylpiperazin-1-yl]ethane-1,2-dione Traditional Name: 1-(2-amino-4-bromo-phenyl)-2-[(2R)-4-benzoyl-2-methyl-piperazino]ethane-1,2-dione Formula: C20H20BrN3O3 MolecularWeight: 430.2951

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20BrN3O3/c1-13-12-23(19(26)14-5-3-2-4-6-14)9-10-24(13)20(27)18(25)16-8-7-15(21)11-17(16)22/h2-8,11,13H,9-10,12,22H2,1H3/t13-/m1/s1