1-[4-[[4-(4-bromanyl-2,5-dimethoxy-phenyl)-3-methyl-butan-2-yl]amino]butyl]piperidin-2-one

Systemtic Name: 1-[4-[[4-(4-bromanyl-2,5-dimethoxy-phenyl)-3-methyl-butan-2-yl]amino]butyl]piperidin-2-one Openeye Name: 1-[4-[[3-(4-bromo-2,5-dimethoxy-phenyl)-1,2-dimethyl-propyl]amino]butyl]piperidin-2-one CAS Name: 1-[4-[[4-(4-bromo-2,5-dimethoxyphenyl)-3-methylbutan-2-yl]amino]butyl]-2-piperidinone IUPAC Name: 1-[4-[[4-(4-bromo-2,5-dimethoxyphenyl)-3-methylbutan-2-yl]amino]butyl]piperidin-2-one Traditional Name: 1-[4-[[3-(4-bromo-2,5-dimethoxy-phenyl)-1,2-dimethyl-propyl]amino]butyl]-2-piperidone Formula: C22H35BrN2O3 MolecularWeight: 455.4289

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=C(C=C1OC)Br)OC)C(C)NCCCCN2CCCCC2=O

Isomeric SMILES

CC(CC1=CC(=C(C=C1OC)Br)OC)C(C)NCCCCN2CCCCC2=O

InChI

InChI=1S/C22H35BrN2O3/c1-16(13-18-14-21(28-4)19(23)15-20(18)27-3)17(2)24-10-6-8-12-25-11-7-5-9-22(25)26/h14-17,24H,5-13H2,1-4H3