1-[3-(3-chloranyl-4-cyclohexyl-phenyl)prop-2-ynyl]-4-phenyl-piperidin-4-ol hydrochloride

Systemtic Name: 1-[3-(3-chloranyl-4-cyclohexyl-phenyl)prop-2-ynyl]-4-phenyl-piperidin-4-ol hydrochloride Openeye Name: 1-[3-(3-chloro-4-cyclohexyl-phenyl)prop-2-ynyl]-4-phenyl-piperidin-4-ol hydrochloride CAS Name: 1-[3-(3-chloro-4-cyclohexylphenyl)prop-2-ynyl]-4-phenyl-4-piperidinol hydrochloride IUPAC Name: 1-[3-(3-chloro-4-cyclohexylphenyl)prop-2-ynyl]-4-phenylpiperidin-4-ol hydrochloride Traditional Name: 1-[3-(3-chloro-4-cyclohexyl-phenyl)prop-2-ynyl]-4-phenyl-piperidin-4-ol hydrochloride Formula: C26H31Cl2NO MolecularWeight: 444.43644

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C=C(C=C2)C#CCN3CCC(CC3)(C4=CC=CC=C4)O)Cl.Cl

Isomeric SMILES

C1CCC(CC1)C2=C(C=C(C=C2)C#CCN3CCC(CC3)(C4=CC=CC=C4)O)Cl.Cl

InChI

InChI=1S/C26H30ClNO.ClH/c27-25-20-21(13-14-24(25)22-9-3-1-4-10-22)8-7-17-28-18-15-26(29,16-19-28)23-11-5-2-6-12-23;/h2,5-6,11-14,20,22,29H,1,3-4,9-10,15-19H2;1H