[(3S)-3-(azepan-1-yl)-3-thiophen-2-yl-propyl]azanium

Systemtic Name: [(3S)-3-(azepan-1-yl)-3-thiophen-2-yl-propyl]azanium Openeye Name: [(3S)-3-(azepan-1-yl)-3-(2-thienyl)propyl]ammonium CAS Name: [(3S)-3-(1-azepanyl)-3-thiophen-2-ylpropyl]ammonium IUPAC Name: [(3S)-3-(azepan-1-yl)-3-thiophen-2-ylpropyl]azanium Traditional Name: [(3S)-3-(azepan-1-yl)-3-(2-thienyl)propyl]ammonium Formula: C13H23N2S+ MolecularWeight: 239.40012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(CC[NH3+])C2=CC=CS2

Isomeric SMILES

C1CCCN(CC1)[C@@H](CC[NH3+])C2=CC=CS2

InChI

InChI=1S/C13H22N2S/c14-8-7-12(13-6-5-11-16-13)15-9-3-1-2-4-10-15/h5-6,11-12H,1-4,7-10,14H2/p+1/t12-/m0/s1