4-[1-(3-phenylpropyl)piperidin-3-yl]sulfonylphenol hydrochloride

Systemtic Name: 4-[1-(3-phenylpropyl)piperidin-3-yl]sulfonylphenol hydrochloride Openeye Name: 4-[[1-(3-phenylpropyl)-3-piperidyl]sulfonyl]phenol hydrochloride CAS Name: 4-[[1-(3-phenylpropyl)-3-piperidinyl]sulfonyl]phenol hydrochloride IUPAC Name: 4-[1-(3-phenylpropyl)piperidin-3-yl]sulfonylphenol hydrochloride Traditional Name: 4-[[1-(3-phenylpropyl)-3-piperidyl]sulfonyl]phenol hydrochloride Formula: C20H26ClNO3S MolecularWeight: 395.94334

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)O.Cl

Isomeric SMILES

C1CC(CN(C1)CCCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)O.Cl

InChI

InChI=1S/C20H25NO3S.ClH/c22-18-10-12-19(13-11-18)25(23,24)20-9-5-15-21(16-20)14-4-8-17-6-2-1-3-7-17;/h1-3,6-7,10-13,20,22H,4-5,8-9,14-16H2;1H