1-[(R)-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-phenyl-methyl]-4-ethyl-piperazine-1,4-diium

Systemtic Name: 1-[(R)-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-phenyl-methyl]-4-ethyl-piperazine-1,4-diium Openeye Name: 1-[(R)-(1-cyclohexyltetrazol-5-yl)-phenyl-methyl]-4-ethyl-piperazine-1,4-diium CAS Name: 1-[(R)-(1-cyclohexyl-5-tetrazolyl)-phenylmethyl]-4-ethylpiperazine-1,4-diium IUPAC Name: 1-[(R)-(1-cyclohexyltetrazol-5-yl)-phenylmethyl]-4-ethylpiperazine-1,4-diium Traditional Name: 1-[(R)-(1-cyclohexyltetrazol-5-yl)-phenyl-methyl]-4-ethyl-piperazine-1,4-diium Formula: C20H32N6+2 MolecularWeight: 356.50828

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)C(C2=CC=CC=C2)C3=NN=NN3C4CCCCC4

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)[C@H](C2=CC=CC=C2)C3=NN=NN3C4CCCCC4

InChI

InChI=1S/C20H30N6/c1-2-24-13-15-25(16-14-24)19(17-9-5-3-6-10-17)20-21-22-23-26(20)18-11-7-4-8-12-18/h3,5-6,9-10,18-19H,2,4,7-8,11-16H2,1H3/p+2/t19-/m1/s1