1-(3-methoxyphenyl)-4-[(3S)-thiolan-3-yl]piperazin-4-ium

Systemtic Name: 1-(3-methoxyphenyl)-4-[(3S)-thiolan-3-yl]piperazin-4-ium Openeye Name: 1-(3-methoxyphenyl)-4-[(3S)-tetrahydrothiophen-3-yl]piperazin-4-ium CAS Name: 1-(3-methoxyphenyl)-4-[(3S)-3-thiolanyl]piperazin-4-ium IUPAC Name: 1-(3-methoxyphenyl)-4-[(3S)-thiolan-3-yl]piperazin-4-ium Traditional Name: 1-(3-methoxyphenyl)-4-[(3S)-tetrahydrothiophen-3-yl]piperazin-4-ium Formula: C15H23N2OS+ MolecularWeight: 279.42092

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC[NH+](CC2)C3CCSC3

Isomeric SMILES

COC1=CC=CC(=C1)N2CC[NH+](CC2)[C@H]3CCSC3

InChI

InChI=1S/C15H22N2OS/c1-18-15-4-2-3-13(11-15)16-6-8-17(9-7-16)14-5-10-19-12-14/h2-4,11,14H,5-10,12H2,1H3/p+1/t14-/m0/s1