1-[(3-bromophenyl)-(3-ethoxy-4-phenylmethoxy-phenyl)methyl]piperazine

Systemtic Name: 1-[(3-bromophenyl)-(3-ethoxy-4-phenylmethoxy-phenyl)methyl]piperazine Openeye Name: 1-[(4-benzyloxy-3-ethoxy-phenyl)-(3-bromophenyl)methyl]piperazine CAS Name: 1-[(3-bromophenyl)-(3-ethoxy-4-phenylmethoxyphenyl)methyl]piperazine IUPAC Name: 1-[(3-bromophenyl)-(3-ethoxy-4-phenylmethoxyphenyl)methyl]piperazine Traditional Name: 1-[(4-benzoxy-3-ethoxy-phenyl)-(3-bromophenyl)methyl]piperazine Formula: C26H29BrN2O2 MolecularWeight: 481.42466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C2=CC(=CC=C2)Br)N3CCNCC3)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C2=CC(=CC=C2)Br)N3CCNCC3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H29BrN2O2/c1-2-30-25-18-22(11-12-24(25)31-19-20-7-4-3-5-8-20)26(29-15-13-28-14-16-29)21-9-6-10-23(27)17-21/h3-12,17-18,26,28H,2,13-16,19H2,1H3