1-[(3-bromophenyl)-(2,3,4-trimethoxyphenyl)methyl]piperazine

Systemtic Name: 1-[(3-bromophenyl)-(2,3,4-trimethoxyphenyl)methyl]piperazine Openeye Name: 1-[(3-bromophenyl)-(2,3,4-trimethoxyphenyl)methyl]piperazine CAS Name: 1-[(3-bromophenyl)-(2,3,4-trimethoxyphenyl)methyl]piperazine IUPAC Name: 1-[(3-bromophenyl)-(2,3,4-trimethoxyphenyl)methyl]piperazine Traditional Name: 1-[(3-bromophenyl)-(2,3,4-trimethoxyphenyl)methyl]piperazine Formula: C20H25BrN2O3 MolecularWeight: 421.3281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25BrN2O3/c1-24-17-8-7-16(19(25-2)20(17)26-3)18(23-11-9-22-10-12-23)14-5-4-6-15(21)13-14/h4-8,13,18,22H,9-12H2,1-3H3