(4-bromanyl-3,5-dimethoxy-phenyl)-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (4-bromanyl-3,5-dimethoxy-phenyl)-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methanone Openeye Name: (4-bromo-3,5-dimethoxy-phenyl)-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methanone CAS Name: (4-bromo-3,5-dimethoxyphenyl)-[4-[(4-methoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (4-bromo-3,5-dimethoxyphenyl)-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (4-bromo-3,5-dimethoxy-phenyl)-(4-p-anisylpiperazino)methanone Formula: C21H25BrN2O4 MolecularWeight: 449.3382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=C(C(=C3)OC)Br)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=C(C(=C3)OC)Br)OC

InChI

InChI=1S/C21H25BrN2O4/c1-26-17-6-4-15(5-7-17)14-23-8-10-24(11-9-23)21(25)16-12-18(27-2)20(22)19(13-16)28-3/h4-7,12-13H,8-11,14H2,1-3H3