3-[1-[(2R)-3-(2-chloranyl-5-methyl-phenoxy)-2-oxidanyl-propyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[(2R)-3-(2-chloranyl-5-methyl-phenoxy)-2-oxidanyl-propyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[(2R)-3-(2-chloro-5-methyl-phenoxy)-2-hydroxy-propyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[(2R)-3-(2-chloro-5-methylphenoxy)-2-hydroxypropyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[(2R)-3-(2-chloro-5-methylphenoxy)-2-hydroxypropyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[(2R)-3-(2-chloro-5-methyl-phenoxy)-2-hydroxy-propyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C22H26ClN3O3 MolecularWeight: 415.91314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OCC(CN2CCC(CC2)N3C4=CC=CC=C4NC3=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OC[C@@H](CN2CCC(CC2)N3C4=CC=CC=C4NC3=O)O

InChI

InChI=1S/C22H26ClN3O3/c1-15-6-7-18(23)21(12-15)29-14-17(27)13-25-10-8-16(9-11-25)26-20-5-3-2-4-19(20)24-22(26)28/h2-7,12,16-17,27H,8-11,13-14H2,1H3,(H,24,28)/t17-/m1/s1