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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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