[(2S)-2-(azepan-1-ium-1-yl)-2-cyclohexyl-ethyl]azanium

Systemtic Name: [(2S)-2-(azepan-1-ium-1-yl)-2-cyclohexyl-ethyl]azanium Openeye Name: [(2S)-2-(azepan-1-ium-1-yl)-2-cyclohexyl-ethyl]ammonium CAS Name: [(2S)-2-(1-azepan-1-iumyl)-2-cyclohexylethyl]ammonium IUPAC Name: [(2S)-2-(azepan-1-ium-1-yl)-2-cyclohexylethyl]azanium Traditional Name: [(2S)-2-(azepan-1-ium-1-yl)-2-cyclohexyl-ethyl]ammonium Formula: C14H30N2+2 MolecularWeight: 226.4014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)C(C[NH3+])C2CCCCC2

Isomeric SMILES

C1CCC[NH+](CC1)[C@H](C[NH3+])C2CCCCC2

InChI

InChI=1S/C14H28N2/c15-12-14(13-8-4-3-5-9-13)16-10-6-1-2-7-11-16/h13-14H,1-12,15H2/p+2/t14-/m1/s1