[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone

Systemtic Name: [4-[[(2R)-oxolan-2-yl]methoxy]phenyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: (4-pyridin-1-ium-2-ylpiperazin-1-yl)-[4-[[(2R)-tetrahydrofuran-2-yl]methoxy]phenyl]methanone CAS Name: [4-[[(2R)-2-oxolanyl]methoxy]phenyl]-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: [4-[[(2R)-oxolan-2-yl]methoxy]phenyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: (4-pyridin-1-ium-2-ylpiperazino)-[4-[[(2R)-tetrahydrofuran-2-yl]methoxy]phenyl]methanone Formula: C21H26N3O3+ MolecularWeight: 368.44944

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

C1C[C@@H](OC1)COC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C21H25N3O3/c25-21(24-13-11-23(12-14-24)20-5-1-2-10-22-20)17-6-8-18(9-7-17)27-16-19-4-3-15-26-19/h1-2,5-10,19H,3-4,11-16H2/p+1/t19-/m1/s1