[(2S)-2-phenylpropyl]-(3-piperidin-1-ium-1-ylpropyl)azanium

Systemtic Name: [(2S)-2-phenylpropyl]-(3-piperidin-1-ium-1-ylpropyl)azanium Openeye Name: [(2S)-2-phenylpropyl]-(3-piperidin-1-ium-1-ylpropyl)ammonium CAS Name: [(2S)-2-phenylpropyl]-[3-(1-piperidin-1-iumyl)propyl]ammonium IUPAC Name: [(2S)-2-phenylpropyl]-(3-piperidin-1-ium-1-ylpropyl)azanium Traditional Name: [(2S)-2-phenylpropyl]-(3-piperidin-1-ium-1-ylpropyl)ammonium Formula: C17H30N2+2 MolecularWeight: 262.4335

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH2+]CCC[NH+]1CCCCC1)C2=CC=CC=C2

Isomeric SMILES

C[C@H](C[NH2+]CCC[NH+]1CCCCC1)C2=CC=CC=C2

InChI

InChI=1S/C17H28N2/c1-16(17-9-4-2-5-10-17)15-18-11-8-14-19-12-6-3-7-13-19/h2,4-5,9-10,16,18H,3,6-8,11-15H2,1H3/p+2/t16-/m1/s1