[(1S)-1-(4-ethylphenyl)ethyl]-(3-piperidin-1-ium-1-ylpropyl)azanium

Systemtic Name: [(1S)-1-(4-ethylphenyl)ethyl]-(3-piperidin-1-ium-1-ylpropyl)azanium Openeye Name: [(1S)-1-(4-ethylphenyl)ethyl]-(3-piperidin-1-ium-1-ylpropyl)ammonium CAS Name: [(1S)-1-(4-ethylphenyl)ethyl]-[3-(1-piperidin-1-iumyl)propyl]ammonium IUPAC Name: [(1S)-1-(4-ethylphenyl)ethyl]-(3-piperidin-1-ium-1-ylpropyl)azanium Traditional Name: [(1S)-1-(4-ethylphenyl)ethyl]-(3-piperidin-1-ium-1-ylpropyl)ammonium Formula: C18H32N2+2 MolecularWeight: 276.46008

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C)[NH2+]CCC[NH+]2CCCCC2

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C)[NH2+]CCC[NH+]2CCCCC2

InChI

InChI=1S/C18H30N2/c1-3-17-8-10-18(11-9-17)16(2)19-12-7-15-20-13-5-4-6-14-20/h8-11,16,19H,3-7,12-15H2,1-2H3/p+2/t16-/m0/s1