1-[1-(phenylmethyl)piperidin-1-ium-4-yl]-4-propan-2-yl-piperazine-1,4-diium

Systemtic Name: 1-[1-(phenylmethyl)piperidin-1-ium-4-yl]-4-propan-2-yl-piperazine-1,4-diium Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-isopropyl-piperazine-1,4-diium CAS Name: 1-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4-propan-2-ylpiperazine-1,4-diium IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-propan-2-ylpiperazine-1,4-diium Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-isopropyl-piperazine-1,4-diium Formula: C19H34N3+3 MolecularWeight: 304.49336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CC[NH+](CC1)C2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)[NH+]1CC[NH+](CC1)C2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H31N3/c1-17(2)21-12-14-22(15-13-21)19-8-10-20(11-9-19)16-18-6-4-3-5-7-18/h3-7,17,19H,8-16H2,1-2H3/p+3