[1-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]piperidin-4-yl]-[(3S)-thiolan-3-yl]azanium

Systemtic Name: [1-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]piperidin-4-yl]-[(3S)-thiolan-3-yl]azanium Openeye Name: [1-[3-(2-oxopyrrolidin-1-yl)phenyl]-4-piperidyl]-[(3S)-tetrahydrothiophen-3-yl]ammonium CAS Name: [1-[3-(2-oxo-1-pyrrolidinyl)phenyl]-4-piperidinyl]-[(3S)-3-thiolanyl]ammonium IUPAC Name: [1-[3-(2-oxopyrrolidin-1-yl)phenyl]piperidin-4-yl]-[(3S)-thiolan-3-yl]azanium Traditional Name: [1-[3-(2-ketopyrrolidino)phenyl]-4-piperidyl]-[(3S)-tetrahydrothiophen-3-yl]ammonium Formula: C19H28N3OS+ MolecularWeight: 346.51012

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC(=CC=C2)N3CCC(CC3)[NH2+]C4CCSC4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC(=CC=C2)N3CCC(CC3)[NH2+][C@H]4CCSC4

InChI

InChI=1S/C19H27N3OS/c23-19-5-2-9-22(19)18-4-1-3-17(13-18)21-10-6-15(7-11-21)20-16-8-12-24-14-16/h1,3-4,13,15-16,20H,2,5-12,14H2/p+1/t16-/m0/s1