1-[(2-bromanyl-4,5-dimethoxy-phenyl)-(2,3-dimethoxyphenyl)methyl]piperazine

Systemtic Name: 1-[(2-bromanyl-4,5-dimethoxy-phenyl)-(2,3-dimethoxyphenyl)methyl]piperazine Openeye Name: 1-[(2-bromo-4,5-dimethoxy-phenyl)-(2,3-dimethoxyphenyl)methyl]piperazine CAS Name: 1-[(2-bromo-4,5-dimethoxyphenyl)-(2,3-dimethoxyphenyl)methyl]piperazine IUPAC Name: 1-[(2-bromo-4,5-dimethoxyphenyl)-(2,3-dimethoxyphenyl)methyl]piperazine Traditional Name: 1-[(2-bromo-4,5-dimethoxy-phenyl)-(2,3-dimethoxyphenyl)methyl]piperazine Formula: C21H27BrN2O4 MolecularWeight: 451.35408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(C2=CC(=C(C=C2Br)OC)OC)N3CCNCC3

Isomeric SMILES

COC1=CC=CC(=C1OC)C(C2=CC(=C(C=C2Br)OC)OC)N3CCNCC3

InChI

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