(2S,5R)-1-[(2-bromophenyl)-phenyl-methyl]-2,5-dimethyl-4-prop-2-enyl-piperazine

Systemtic Name: (2S,5R)-1-[(2-bromophenyl)-phenyl-methyl]-2,5-dimethyl-4-prop-2-enyl-piperazine Openeye Name: (2R,5S)-1-allyl-4-[(2-bromophenyl)-phenyl-methyl]-2,5-dimethyl-piperazine CAS Name: (2S,5R)-1-[(2-bromophenyl)-phenylmethyl]-2,5-dimethyl-4-prop-2-enylpiperazine IUPAC Name: (2S,5R)-1-[(2-bromophenyl)-phenylmethyl]-2,5-dimethyl-4-prop-2-enylpiperazine Traditional Name: (2R,5S)-1-allyl-4-[(2-bromophenyl)-phenyl-methyl]-2,5-dimethyl-piperazine Formula: C22H27BrN2 MolecularWeight: 399.36718

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C(C2=CC=CC=C2)C3=CC=CC=C3Br)C)CC=C

Isomeric SMILES

C[C@H]1CN([C@@H](CN1C(C2=CC=CC=C2)C3=CC=CC=C3Br)C)CC=C

InChI

InChI=1S/C22H27BrN2/c1-4-14-24-15-18(3)25(16-17(24)2)22(19-10-6-5-7-11-19)20-12-8-9-13-21(20)23/h4-13,17-18,22H,1,14-16H2,2-3H3/t17-,18+,22?/m1/s1