(2S)-5-[4-(oxan-4-ylmethyl)piperazin-1-yl]-1-phenyl-pentan-2-amine hydrochloride

Systemtic Name: (2S)-5-[4-(oxan-4-ylmethyl)piperazin-1-yl]-1-phenyl-pentan-2-amine hydrochloride Openeye Name: (2S)-1-phenyl-5-[4-(tetrahydropyran-4-ylmethyl)piperazin-1-yl]pentan-2-amine hydrochloride CAS Name: (2S)-5-[4-(4-oxanylmethyl)-1-piperazinyl]-1-phenyl-2-pentanamine hydrochloride IUPAC Name: (2S)-5-[4-(oxan-4-ylmethyl)piperazin-1-yl]-1-phenylpentan-2-amine hydrochloride Traditional Name: [(1S)-1-benzyl-4-[4-(tetrahydropyran-4-ylmethyl)piperazino]butyl]amine hydrochloride Formula: C21H36ClN3O MolecularWeight: 381.98304

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1CN2CCN(CC2)CCCC(CC3=CC=CC=C3)N.Cl

Isomeric SMILES

C1COCCC1CN2CCN(CC2)CCC[C@@H](CC3=CC=CC=C3)N.Cl

InChI

InChI=1S/C21H35N3O.ClH/c22-21(17-19-5-2-1-3-6-19)7-4-10-23-11-13-24(14-12-23)18-20-8-15-25-16-9-20;/h1-3,5-6,20-21H,4,7-18,22H2;1H/t21-;/m0./s1