[(2S)-4-phenyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)butyl]azanium

Systemtic Name: [(2S)-4-phenyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)butyl]azanium Openeye Name: [(2S)-4-phenyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)butyl]ammonium CAS Name: [(2S)-4-phenyl-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]butyl]ammonium IUPAC Name: [(2S)-4-phenyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)butyl]azanium Traditional Name: [(2S)-4-phenyl-2-(4-pyridin-1-ium-2-ylpiperazino)butyl]ammonium Formula: C19H28N4+2 MolecularWeight: 312.45242

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(CCC3=CC=CC=C3)C[NH3+]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)[C@@H](CCC3=CC=CC=C3)C[NH3+]

InChI

InChI=1S/C19H26N4/c20-16-18(10-9-17-6-2-1-3-7-17)22-12-14-23(15-13-22)19-8-4-5-11-21-19/h1-8,11,18H,9-10,12-16,20H2/p+2/t18-/m0/s1