3-(3-bromanyl-4-methoxy-phenyl)-1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]propan-1-one

Systemtic Name: 3-(3-bromanyl-4-methoxy-phenyl)-1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]propan-1-one Openeye Name: 3-(3-bromo-4-methoxy-phenyl)-1-[4-[(3,5-dimethylisoxazol-4-yl)methyl]piperazin-1-yl]propan-1-one CAS Name: 3-(3-bromo-4-methoxyphenyl)-1-[4-[(3,5-dimethyl-4-isoxazolyl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(3-bromo-4-methoxyphenyl)-1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]propan-1-one Traditional Name: 3-(3-bromo-4-methoxy-phenyl)-1-[4-[(3,5-dimethylisoxazol-4-yl)methyl]piperazino]propan-1-one Formula: C20H26BrN3O3 MolecularWeight: 436.34274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2CCN(CC2)C(=O)CCC3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CC1=C(C(=NO1)C)CN2CCN(CC2)C(=O)CCC3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C20H26BrN3O3/c1-14-17(15(2)27-22-14)13-23-8-10-24(11-9-23)20(25)7-5-16-4-6-19(26-3)18(21)12-16/h4,6,12H,5,7-11,13H2,1-3H3