(3S,4S)-1-(3-phenylpropyl)-4-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidin-3-ol

Systemtic Name: (3S,4S)-1-(3-phenylpropyl)-4-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidin-3-ol Openeye Name: (3S,4S)-1-(3-phenylpropyl)-4-[4-(2-pyridyl)piperazin-1-yl]pyrrolidin-3-ol CAS Name: (3S,4S)-1-(3-phenylpropyl)-4-[4-(2-pyridinyl)-1-piperazinyl]-3-pyrrolidinol IUPAC Name: (3S,4S)-1-(3-phenylpropyl)-4-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidin-3-ol Traditional Name: (3S,4S)-1-(3-phenylpropyl)-4-[4-(2-pyridyl)piperazino]pyrrolidin-3-ol Formula: C22H30N4O MolecularWeight: 366.4998

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2CN(CC2O)CCCC3=CC=CC=C3)C4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1[C@H]2CN(C[C@@H]2O)CCCC3=CC=CC=C3)C4=CC=CC=N4

InChI

InChI=1S/C22H30N4O/c27-21-18-24(12-6-9-19-7-2-1-3-8-19)17-20(21)25-13-15-26(16-14-25)22-10-4-5-11-23-22/h1-5,7-8,10-11,20-21,27H,6,9,12-18H2/t20-,21-/m0/s1