1-(furan-2-ylmethyl)-4-[(1R,3S)-3-methylcyclohexyl]piperazine-1,4-diium

Systemtic Name: 1-(furan-2-ylmethyl)-4-[(1R,3S)-3-methylcyclohexyl]piperazine-1,4-diium Openeye Name: 1-(2-furylmethyl)-4-[(1R,3S)-3-methylcyclohexyl]piperazine-1,4-diium CAS Name: 1-(2-furanylmethyl)-4-[(1R,3S)-3-methylcyclohexyl]piperazine-1,4-diium IUPAC Name: 1-(furan-2-ylmethyl)-4-[(1R,3S)-3-methylcyclohexyl]piperazine-1,4-diium Traditional Name: 1-(2-furfuryl)-4-[(1R,3S)-3-methylcyclohexyl]piperazine-1,4-diium Formula: C16H28N2O+2 MolecularWeight: 264.40632

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)[NH+]2CC[NH+](CC2)CC3=CC=CO3

Isomeric SMILES

C[C@H]1CCC[C@H](C1)[NH+]2CC[NH+](CC2)CC3=CC=CO3

InChI

InChI=1S/C16H26N2O/c1-14-4-2-5-15(12-14)18-9-7-17(8-10-18)13-16-6-3-11-19-16/h3,6,11,14-15H,2,4-5,7-10,12-13H2,1H3/p+2/t14-,15+/m0/s1