[(3S)-3-(azepan-1-ium-1-yl)-3-phenyl-propyl]azanium

Systemtic Name: [(3S)-3-(azepan-1-ium-1-yl)-3-phenyl-propyl]azanium Openeye Name: [(3S)-3-(azepan-1-ium-1-yl)-3-phenyl-propyl]ammonium CAS Name: [(3S)-3-(1-azepan-1-iumyl)-3-phenylpropyl]ammonium IUPAC Name: [(3S)-3-(azepan-1-ium-1-yl)-3-phenylpropyl]azanium Traditional Name: [(3S)-3-(azepan-1-ium-1-yl)-3-phenyl-propyl]ammonium Formula: C15H26N2+2 MolecularWeight: 234.38034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)C(CC[NH3+])C2=CC=CC=C2

Isomeric SMILES

C1CCC[NH+](CC1)[C@@H](CC[NH3+])C2=CC=CC=C2

InChI

InChI=1S/C15H24N2/c16-11-10-15(14-8-4-3-5-9-14)17-12-6-1-2-7-13-17/h3-5,8-9,15H,1-2,6-7,10-13,16H2/p+2/t15-/m0/s1