1-cyclopentyl-4-[(1S)-1-(1-phenethyl-1,2,3,4-tetrazol-5-yl)pentyl]piperazin-1-ium

Systemtic Name: 1-cyclopentyl-4-[(1S)-1-(1-phenethyl-1,2,3,4-tetrazol-5-yl)pentyl]piperazin-1-ium Openeye Name: 1-cyclopentyl-4-[(1S)-1-(1-phenethyltetrazol-5-yl)pentyl]piperazin-1-ium CAS Name: 1-cyclopentyl-4-[(1S)-1-(1-phenethyl-5-tetrazolyl)pentyl]piperazin-1-ium IUPAC Name: 1-cyclopentyl-4-[(1S)-1-(1-phenethyltetrazol-5-yl)pentyl]piperazin-1-ium Traditional Name: 1-cyclopentyl-4-[(1S)-1-(1-phenethyltetrazol-5-yl)pentyl]piperazin-1-ium Formula: C23H37N6+ MolecularWeight: 397.58008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=NN=NN1CCC2=CC=CC=C2)N3CC[NH+](CC3)C4CCCC4

Isomeric SMILES

CCCC[C@@H](C1=NN=NN1CCC2=CC=CC=C2)N3CC[NH+](CC3)C4CCCC4

InChI

InChI=1S/C23H36N6/c1-2-3-13-22(28-18-16-27(17-19-28)21-11-7-8-12-21)23-24-25-26-29(23)15-14-20-9-5-4-6-10-20/h4-6,9-10,21-22H,2-3,7-8,11-19H2,1H3/p+1/t22-/m0/s1