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1-[(1R)-1-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-2-methyl-propyl]azepan-1-ium

1-[(1R)-1-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-2-methyl-propyl]azepan-1-ium

Systemtic Name:1-[(1R)-1-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-2-methyl-propyl]azepan-1-ium
Openeye Name:1-[(1R)-1-(1-cyclohexyltetrazol-5-yl)-2-methyl-propyl]azepan-1-ium
CAS Name:1-[(1R)-1-(1-cyclohexyl-5-tetrazolyl)-2-methylpropyl]azepan-1-ium
IUPAC Name:1-[(1R)-1-(1-cyclohexyltetrazol-5-yl)-2-methylpropyl]azepan-1-ium
Traditional Name:1-[(1R)-1-(1-cyclohexyltetrazol-5-yl)-2-methyl-propyl]azepan-1-ium
Formula: C17H32N5+
MolecularWeight: 306.46948
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=NN=NN1C2CCCCC2)[NH+]3CCCCCC3


Isomeric SMILES

CC(C)[C@H](C1=NN=NN1C2CCCCC2)[NH+]3CCCCCC3


InChI

InChI=1S/C17H31N5/c1-14(2)16(21-12-8-3-4-9-13-21)17-18-19-20-22(17)15-10-6-5-7-11-15/h14-16H,3-13H2,1-2H3/p+1/t16-/m1/s1


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