1-[2,5-bis(bromanyl)phenyl]sulfonyl-4-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]piperazine

Systemtic Name: 1-[2,5-bis(bromanyl)phenyl]sulfonyl-4-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]piperazine Openeye Name: 1-[(3-benzyloxy-4-methoxy-phenyl)methyl]-4-(2,5-dibromophenyl)sulfonyl-piperazine CAS Name: 1-(2,5-dibromophenyl)sulfonyl-4-[(4-methoxy-3-phenylmethoxyphenyl)methyl]piperazine IUPAC Name: 1-(2,5-dibromophenyl)sulfonyl-4-[(4-methoxy-3-phenylmethoxyphenyl)methyl]piperazine Traditional Name: 1-(3-benzoxy-4-methoxy-benzyl)-4-(2,5-dibromophenyl)sulfonyl-piperazine Formula: C25H26Br2N2O4S MolecularWeight: 610.35794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Br)Br)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Br)Br)OCC4=CC=CC=C4

InChI

InChI=1S/C25H26Br2N2O4S/c1-32-23-10-7-20(15-24(23)33-18-19-5-3-2-4-6-19)17-28-11-13-29(14-12-28)34(30,31)25-16-21(26)8-9-22(25)27/h2-10,15-16H,11-14,17-18H2,1H3