1-(2,3-dihydro-1H-inden-2-yl)-4-pyridin-1-ium-2-yl-piperazin-1-ium

Systemtic Name: 1-(2,3-dihydro-1H-inden-2-yl)-4-pyridin-1-ium-2-yl-piperazin-1-ium Openeye Name: 1-indan-2-yl-4-pyridin-1-ium-2-yl-piperazin-1-ium CAS Name: 1-(2,3-dihydro-1H-inden-2-yl)-4-(2-pyridin-1-iumyl)piperazin-1-ium IUPAC Name: 1-(2,3-dihydro-1H-inden-2-yl)-4-pyridin-1-ium-2-ylpiperazin-1-ium Traditional Name: 1-indan-2-yl-4-pyridin-1-ium-2-yl-piperazin-1-ium Formula: C18H23N3+2 MolecularWeight: 281.39532

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2CC3=CC=CC=C3C2)C4=CC=CC=[NH+]4

Isomeric SMILES

C1CN(CC[NH+]1C2CC3=CC=CC=C3C2)C4=CC=CC=[NH+]4

InChI

InChI=1S/C18H21N3/c1-2-6-16-14-17(13-15(16)5-1)20-9-11-21(12-10-20)18-7-3-4-8-19-18/h1-8,17H,9-14H2/p+2