4-[[2-[3-[cyclohexyl(methyl)amino]-2-oxidanyl-propoxy]phenyl]methyl]piperazin-2-one

Systemtic Name: 4-[[2-[3-[cyclohexyl(methyl)amino]-2-oxidanyl-propoxy]phenyl]methyl]piperazin-2-one Openeye Name: 4-[[2-[3-[cyclohexyl(methyl)amino]-2-hydroxy-propoxy]phenyl]methyl]piperazin-2-one CAS Name: 4-[[2-[3-[cyclohexyl(methyl)amino]-2-hydroxypropoxy]phenyl]methyl]-2-piperazinone IUPAC Name: 4-[[2-[3-[cyclohexyl(methyl)amino]-2-hydroxypropoxy]phenyl]methyl]piperazin-2-one Traditional Name: 4-[2-[3-[cyclohexyl(methyl)amino]-2-hydroxy-propoxy]benzyl]piperazin-2-one Formula: C21H33N3O3 MolecularWeight: 375.50502

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(COC1=CC=CC=C1CN2CCNC(=O)C2)O)C3CCCCC3

Isomeric SMILES

CN(CC(COC1=CC=CC=C1CN2CCNC(=O)C2)O)C3CCCCC3

InChI

InChI=1S/C21H33N3O3/c1-23(18-8-3-2-4-9-18)14-19(25)16-27-20-10-6-5-7-17(20)13-24-12-11-22-21(26)15-24/h5-7,10,18-19,25H,2-4,8-9,11-16H2,1H3,(H,22,26)