1-[(3-bromophenyl)-(3,5-dimethoxy-4-phenylmethoxy-phenyl)methyl]piperazine

Systemtic Name: 1-[(3-bromophenyl)-(3,5-dimethoxy-4-phenylmethoxy-phenyl)methyl]piperazine Openeye Name: 1-[(4-benzyloxy-3,5-dimethoxy-phenyl)-(3-bromophenyl)methyl]piperazine CAS Name: 1-[(3-bromophenyl)-(3,5-dimethoxy-4-phenylmethoxyphenyl)methyl]piperazine IUPAC Name: 1-[(3-bromophenyl)-(3,5-dimethoxy-4-phenylmethoxyphenyl)methyl]piperazine Traditional Name: 1-[(4-benzoxy-3,5-dimethoxy-phenyl)-(3-bromophenyl)methyl]piperazine Formula: C26H29BrN2O3 MolecularWeight: 497.42406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)C(C3=CC(=CC=C3)Br)N4CCNCC4

Isomeric SMILES

COC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)C(C3=CC(=CC=C3)Br)N4CCNCC4

InChI

InChI=1S/C26H29BrN2O3/c1-30-23-16-21(17-24(31-2)26(23)32-18-19-7-4-3-5-8-19)25(29-13-11-28-12-14-29)20-9-6-10-22(27)15-20/h3-10,15-17,25,28H,11-14,18H2,1-2H3