(3R)-4-cyclopentyl-3-[2-oxidanylidene-2-(4-pyridin-3-yloxypiperidin-1-yl)ethyl]piperazin-4-ium-2-one

Systemtic Name: (3R)-4-cyclopentyl-3-[2-oxidanylidene-2-(4-pyridin-3-yloxypiperidin-1-yl)ethyl]piperazin-4-ium-2-one Openeye Name: (3R)-4-cyclopentyl-3-[2-oxo-2-[4-(3-pyridyloxy)-1-piperidyl]ethyl]piperazin-4-ium-2-one CAS Name: (3R)-4-cyclopentyl-3-[2-oxo-2-[4-(3-pyridinyloxy)-1-piperidinyl]ethyl]-2-piperazin-4-iumone IUPAC Name: (3R)-4-cyclopentyl-3-[2-oxo-2-(4-pyridin-3-yloxypiperidin-1-yl)ethyl]piperazin-4-ium-2-one Traditional Name: (3R)-4-cyclopentyl-3-[2-keto-2-[4-(3-pyridyloxy)piperidino]ethyl]piperazin-4-ium-2-one Formula: C21H31N4O3+ MolecularWeight: 387.49584

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCNC(=O)C2CC(=O)N3CCC(CC3)OC4=CN=CC=C4

Isomeric SMILES

C1CCC(C1)[NH+]2CCNC(=O)[C@H]2CC(=O)N3CCC(CC3)OC4=CN=CC=C4

InChI

InChI=1S/C21H30N4O3/c26-20(14-19-21(27)23-10-13-25(19)16-4-1-2-5-16)24-11-7-17(8-12-24)28-18-6-3-9-22-15-18/h3,6,9,15-17,19H,1-2,4-5,7-8,10-14H2,(H,23,27)/p+1/t19-/m1/s1