[1-[(5-bromanyl-2,4-dimethoxy-phenyl)methyl]piperidin-2-yl]methyl 4-(4-methoxyphenyl)-3-methyl-piperazine-1-carboxylate

Systemtic Name: [1-[(5-bromanyl-2,4-dimethoxy-phenyl)methyl]piperidin-2-yl]methyl 4-(4-methoxyphenyl)-3-methyl-piperazine-1-carboxylate Openeye Name: [1-[(5-bromo-2,4-dimethoxy-phenyl)methyl]-2-piperidyl]methyl 4-(4-methoxyphenyl)-3-methyl-piperazine-1-carboxylate CAS Name: 4-(4-methoxyphenyl)-3-methyl-1-piperazinecarboxylic acid [1-[(5-bromo-2,4-dimethoxyphenyl)methyl]-2-piperidinyl]methyl ester IUPAC Name: [1-[(5-bromo-2,4-dimethoxyphenyl)methyl]piperidin-2-yl]methyl 4-(4-methoxyphenyl)-3-methylpiperazine-1-carboxylate Traditional Name: 4-(4-methoxyphenyl)-3-methyl-piperazine-1-carboxylic acid [1-(5-bromo-2,4-dimethoxy-benzyl)-2-piperidyl]methyl ester Formula: C28H38BrN3O5 MolecularWeight: 576.52242

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)OC)C(=O)OCC3CCCCN3CC4=CC(=C(C=C4OC)OC)Br

Isomeric SMILES

CC1CN(CCN1C2=CC=C(C=C2)OC)C(=O)OCC3CCCCN3CC4=CC(=C(C=C4OC)OC)Br

InChI

InChI=1S/C28H38BrN3O5/c1-20-17-31(13-14-32(20)22-8-10-24(34-2)11-9-22)28(33)37-19-23-7-5-6-12-30(23)18-21-15-25(29)27(36-4)16-26(21)35-3/h8-11,15-16,20,23H,5-7,12-14,17-19H2,1-4H3