(3S)-1-(1,4-dithiepan-6-yl)-3-pyrrolidin-1-ium-1-yl-piperidine

Systemtic Name: (3S)-1-(1,4-dithiepan-6-yl)-3-pyrrolidin-1-ium-1-yl-piperidine Openeye Name: (3S)-1-(1,4-dithiepan-6-yl)-3-pyrrolidin-1-ium-1-yl-piperidine CAS Name: (3S)-1-(1,4-dithiepan-6-yl)-3-(1-pyrrolidin-1-iumyl)piperidine IUPAC Name: (3S)-1-(1,4-dithiepan-6-yl)-3-pyrrolidin-1-ium-1-ylpiperidine Traditional Name: (3S)-1-(1,4-dithiepan-6-yl)-3-pyrrolidin-1-ium-1-yl-piperidine Formula: C14H27N2S2+ MolecularWeight: 287.50758

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C2CCCN(C2)C3CSCCSC3

Isomeric SMILES

C1CC[NH+](C1)[C@H]2CCCN(C2)C3CSCCSC3

InChI

InChI=1S/C14H26N2S2/c1-2-6-15(5-1)13-4-3-7-16(10-13)14-11-17-8-9-18-12-14/h13-14H,1-12H2/p+1/t13-/m0/s1