1-(3-phenylpropyl)-4-propan-2-yl-piperazine-1,4-diium

Systemtic Name: 1-(3-phenylpropyl)-4-propan-2-yl-piperazine-1,4-diium Openeye Name: 1-isopropyl-4-(3-phenylpropyl)piperazine-1,4-diium CAS Name: 1-(3-phenylpropyl)-4-propan-2-ylpiperazine-1,4-diium IUPAC Name: 1-(3-phenylpropyl)-4-propan-2-ylpiperazine-1,4-diium Traditional Name: 1-isopropyl-4-(3-phenylpropyl)piperazine-1,4-diium Formula: C16H28N2+2 MolecularWeight: 248.40692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CC[NH+](CC1)CCCC2=CC=CC=C2

Isomeric SMILES

CC(C)[NH+]1CC[NH+](CC1)CCCC2=CC=CC=C2

InChI

InChI=1S/C16H26N2/c1-15(2)18-13-11-17(12-14-18)10-6-9-16-7-4-3-5-8-16/h3-5,7-8,15H,6,9-14H2,1-2H3/p+2