[(2R,4S)-2-(azepan-1-ium-1-yl)-2-ethyl-4-methyl-hexyl]azanium

Systemtic Name: [(2R,4S)-2-(azepan-1-ium-1-yl)-2-ethyl-4-methyl-hexyl]azanium Openeye Name: [(2R,4S)-2-(azepan-1-ium-1-yl)-2-ethyl-4-methyl-hexyl]ammonium CAS Name: [(2R,4S)-2-(1-azepan-1-iumyl)-2-ethyl-4-methylhexyl]ammonium IUPAC Name: [(2R,4S)-2-(azepan-1-ium-1-yl)-2-ethyl-4-methylhexyl]azanium Traditional Name: [(2R,4S)-2-(azepan-1-ium-1-yl)-2-ethyl-4-methyl-hexyl]ammonium Formula: C15H34N2+2 MolecularWeight: 242.44386

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(CC)(C[NH3+])[NH+]1CCCCCC1

Isomeric SMILES

CC[C@H](C)C[C@](CC)(C[NH3+])[NH+]1CCCCCC1

InChI

InChI=1S/C15H32N2/c1-4-14(3)12-15(5-2,13-16)17-10-8-6-7-9-11-17/h14H,4-13,16H2,1-3H3/p+2/t14-,15+/m0/s1