[(2R)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-thiophen-3-yl-ethyl]azanium

Systemtic Name: [(2R)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-thiophen-3-yl-ethyl]azanium Openeye Name: [(2R)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-(3-thienyl)ethyl]ammonium CAS Name: [(2R)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-(3-thiophenyl)ethyl]ammonium IUPAC Name: [(2R)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-thiophen-3-ylethyl]azanium Traditional Name: [(2R)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-(3-thienyl)ethyl]ammonium Formula: C12H23N3S+2 MolecularWeight: 241.39612

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(C[NH3+])C2=CSC=C2

Isomeric SMILES

C[NH+]1CCCN(CC1)[C@@H](C[NH3+])C2=CSC=C2

InChI

InChI=1S/C12H21N3S/c1-14-4-2-5-15(7-6-14)12(9-13)11-3-8-16-10-11/h3,8,10,12H,2,4-7,9,13H2,1H3/p+2/t12-/m0/s1