1-[2-[(3R)-3-azanylpiperidin-1-yl]-1-(3-chloranyl-4-phenylmethoxy-phenyl)ethyl]cyclohexan-1-ol

Systemtic Name: 1-[2-[(3R)-3-azanylpiperidin-1-yl]-1-(3-chloranyl-4-phenylmethoxy-phenyl)ethyl]cyclohexan-1-ol Openeye Name: 1-[2-[(3R)-3-amino-1-piperidyl]-1-(4-benzyloxy-3-chloro-phenyl)ethyl]cyclohexanol CAS Name: 1-[2-[(3R)-3-amino-1-piperidinyl]-1-(3-chloro-4-phenylmethoxyphenyl)ethyl]-1-cyclohexanol IUPAC Name: 1-[2-[(3R)-3-aminopiperidin-1-yl]-1-(3-chloro-4-phenylmethoxyphenyl)ethyl]cyclohexan-1-ol Traditional Name: 1-[2-[(3R)-3-aminopiperidino]-1-(4-benzoxy-3-chloro-phenyl)ethyl]cyclohexanol Formula: C26H35ClN2O2 MolecularWeight: 443.0213

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(CN2CCCC(C2)N)C3=CC(=C(C=C3)OCC4=CC=CC=C4)Cl)O

Isomeric SMILES

C1CCC(CC1)(C(CN2CCC[C@H](C2)N)C3=CC(=C(C=C3)OCC4=CC=CC=C4)Cl)O

InChI

InChI=1S/C26H35ClN2O2/c27-24-16-21(11-12-25(24)31-19-20-8-3-1-4-9-20)23(26(30)13-5-2-6-14-26)18-29-15-7-10-22(28)17-29/h1,3-4,8-9,11-12,16,22-23,30H,2,5-7,10,13-15,17-19,28H2/t22-,23?/m1/s1