(E)-3-(2-bromophenyl)-1-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(2-bromophenyl)-1-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(2-bromophenyl)-1-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]prop-2-en-1-one CAS Name: (E)-3-(2-bromophenyl)-1-[(2R)-4-methyl-2-phenyl-1-piperazin-4-iumyl]-2-propen-1-one IUPAC Name: (E)-3-(2-bromophenyl)-1-[(2R)-4-methyl-2-phenylpiperazin-4-ium-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(2-bromophenyl)-1-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]prop-2-en-1-one Formula: C20H22BrN2O+ MolecularWeight: 386.30548

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)C(=O)C=CC3=CC=CC=C3Br

Isomeric SMILES

C[NH+]1CCN([C@@H](C1)C2=CC=CC=C2)C(=O)/C=C/C3=CC=CC=C3Br

InChI

InChI=1S/C20H21BrN2O/c1-22-13-14-23(19(15-22)17-8-3-2-4-9-17)20(24)12-11-16-7-5-6-10-18(16)21/h2-12,19H,13-15H2,1H3/p+1/b12-11+/t19-/m0/s1