(6R)-1-cyclohexyl-4-(1H-imidazol-2-ylmethyl)-6-oxidanyl-1,4-diazepan-4-ium-2-one

Systemtic Name: (6R)-1-cyclohexyl-4-(1H-imidazol-2-ylmethyl)-6-oxidanyl-1,4-diazepan-4-ium-2-one Openeye Name: (6R)-1-cyclohexyl-6-hydroxy-4-(1H-imidazol-2-ylmethyl)-1,4-diazepan-4-ium-2-one CAS Name: (6R)-1-cyclohexyl-6-hydroxy-4-(1H-imidazol-2-ylmethyl)-1,4-diazepan-4-ium-2-one IUPAC Name: (6R)-1-cyclohexyl-6-hydroxy-4-(1H-imidazol-2-ylmethyl)-1,4-diazepan-4-ium-2-one Traditional Name: (6R)-1-cyclohexyl-6-hydroxy-4-(1H-imidazol-2-ylmethyl)-1,4-diazepan-4-ium-2-one Formula: C15H25N4O2+ MolecularWeight: 293.3846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(C[NH+](CC2=O)CC3=NC=CN3)O

Isomeric SMILES

C1CCC(CC1)N2C[C@H](C[NH+](CC2=O)CC3=NC=CN3)O

InChI

InChI=1S/C15H24N4O2/c20-13-8-18(10-14-16-6-7-17-14)11-15(21)19(9-13)12-4-2-1-3-5-12/h6-7,12-13,20H,1-5,8-11H2,(H,16,17)/p+1/t13-/m0/s1