[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]-[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]methanone

Systemtic Name: [(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]-[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]methanone Openeye Name: [(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]-[4-[[(2R)-tetrahydrofuran-2-yl]methoxy]phenyl]methanone CAS Name: [(2S)-4-methyl-2-phenyl-1-piperazin-4-iumyl]-[4-[[(2R)-2-oxolanyl]methoxy]phenyl]methanone IUPAC Name: [(2S)-4-methyl-2-phenylpiperazin-4-ium-1-yl]-[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]methanone Traditional Name: [(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]-[4-[[(2R)-tetrahydrofuran-2-yl]methoxy]phenyl]methanone Formula: C23H29N2O3+ MolecularWeight: 381.48796

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)OCC4CCCO4

Isomeric SMILES

C[NH+]1CCN([C@H](C1)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)OC[C@H]4CCCO4

InChI

InChI=1S/C23H28N2O3/c1-24-13-14-25(22(16-24)18-6-3-2-4-7-18)23(26)19-9-11-20(12-10-19)28-17-21-8-5-15-27-21/h2-4,6-7,9-12,21-22H,5,8,13-17H2,1H3/p+1/t21-,22-/m1/s1