3-[[4-[(3S)-3-phenethylpiperidin-1-ium-1-yl]piperidin-1-ium-1-yl]methyl]pyridine

Systemtic Name: 3-[[4-[(3S)-3-phenethylpiperidin-1-ium-1-yl]piperidin-1-ium-1-yl]methyl]pyridine Openeye Name: 3-[[4-[(3S)-3-phenethylpiperidin-1-ium-1-yl]piperidin-1-ium-1-yl]methyl]pyridine CAS Name: 3-[[4-[(3S)-3-phenethyl-1-piperidin-1-iumyl]-1-piperidin-1-iumyl]methyl]pyridine IUPAC Name: 3-[[4-[(3S)-3-phenethylpiperidin-1-ium-1-yl]piperidin-1-ium-1-yl]methyl]pyridine Traditional Name: 3-[[4-[(3S)-3-phenethylpiperidin-1-ium-1-yl]piperidin-1-ium-1-yl]methyl]pyridine Formula: C24H35N3+2 MolecularWeight: 365.5548

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)C2CC[NH+](CC2)CC3=CN=CC=C3)CCC4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)C2CC[NH+](CC2)CC3=CN=CC=C3)CCC4=CC=CC=C4

InChI

InChI=1S/C24H33N3/c1-2-6-21(7-3-1)10-11-22-9-5-15-27(20-22)24-12-16-26(17-13-24)19-23-8-4-14-25-18-23/h1-4,6-8,14,18,22,24H,5,9-13,15-17,19-20H2/p+2/t22-/m1/s1