1-[(2-bromanyl-4,5-dimethoxy-phenyl)-(2,6-dimethoxyphenyl)methyl]piperazine

Systemtic Name: 1-[(2-bromanyl-4,5-dimethoxy-phenyl)-(2,6-dimethoxyphenyl)methyl]piperazine Openeye Name: 1-[(2-bromo-4,5-dimethoxy-phenyl)-(2,6-dimethoxyphenyl)methyl]piperazine CAS Name: 1-[(2-bromo-4,5-dimethoxyphenyl)-(2,6-dimethoxyphenyl)methyl]piperazine IUPAC Name: 1-[(2-bromo-4,5-dimethoxyphenyl)-(2,6-dimethoxyphenyl)methyl]piperazine Traditional Name: 1-[(2-bromo-4,5-dimethoxy-phenyl)-(2,6-dimethoxyphenyl)methyl]piperazine Formula: C21H27BrN2O4 MolecularWeight: 451.35408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(C2=CC(=C(C=C2Br)OC)OC)N3CCNCC3

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(C2=CC(=C(C=C2Br)OC)OC)N3CCNCC3

InChI

InChI=1S/C21H27BrN2O4/c1-25-16-6-5-7-17(26-2)20(16)21(24-10-8-23-9-11-24)14-12-18(27-3)19(28-4)13-15(14)22/h5-7,12-13,21,23H,8-11H2,1-4H3