(2S)-1-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-3-cyclopentyloxy-propan-2-ol

Systemtic Name: (2S)-1-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-3-cyclopentyloxy-propan-2-ol Openeye Name: (2S)-1-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-3-(cyclopentoxy)propan-2-ol CAS Name: (2S)-1-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]-3-cyclopentyloxy-2-propanol IUPAC Name: (2S)-1-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-3-cyclopentyloxypropan-2-ol Traditional Name: (2S)-1-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-3-(cyclopentoxy)propan-2-ol Formula: C18H28ClN2O2+ MolecularWeight: 339.88012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OCC(C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl)O

Isomeric SMILES

C1CCC(C1)OC[C@H](C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl)O

InChI

InChI=1S/C18H27ClN2O2/c19-15-4-3-5-16(12-15)21-10-8-20(9-11-21)13-17(22)14-23-18-6-1-2-7-18/h3-5,12,17-18,22H,1-2,6-11,13-14H2/p+1/t17-/m0/s1