1-[4-oxidanyl-2-oxidanylidene-5-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]pentyl]azepan-2-one

Systemtic Name: 1-[4-oxidanyl-2-oxidanylidene-5-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]pentyl]azepan-2-one Openeye Name: 1-[4-hydroxy-5-[4-(2-isopropoxyphenyl)piperazin-1-yl]-2-oxo-pentyl]azepan-2-one CAS Name: 1-[4-hydroxy-2-oxo-5-[4-(2-propan-2-yloxyphenyl)-1-piperazinyl]pentyl]-2-azepanone IUPAC Name: 1-[4-hydroxy-2-oxo-5-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]pentyl]azepan-2-one Traditional Name: 1-[4-hydroxy-5-[4-(2-isopropoxyphenyl)piperazino]-2-keto-pentyl]azepan-2-one Formula: C24H37N3O4 MolecularWeight: 431.56828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1N2CCN(CC2)CC(CC(=O)CN3CCCCCC3=O)O

Isomeric SMILES

CC(C)OC1=CC=CC=C1N2CCN(CC2)CC(CC(=O)CN3CCCCCC3=O)O

InChI

InChI=1S/C24H37N3O4/c1-19(2)31-23-9-6-5-8-22(23)26-14-12-25(13-15-26)17-20(28)16-21(29)18-27-11-7-3-4-10-24(27)30/h5-6,8-9,19-20,28H,3-4,7,10-18H2,1-2H3