(6R)-1-cyclohexyl-4-(oxan-4-yl)-6-oxidanyl-1,4-diazepan-4-ium-2-one

Systemtic Name: (6R)-1-cyclohexyl-4-(oxan-4-yl)-6-oxidanyl-1,4-diazepan-4-ium-2-one Openeye Name: (6R)-1-cyclohexyl-6-hydroxy-4-tetrahydropyran-4-yl-1,4-diazepan-4-ium-2-one CAS Name: (6R)-1-cyclohexyl-6-hydroxy-4-(4-oxanyl)-1,4-diazepan-4-ium-2-one IUPAC Name: (6R)-1-cyclohexyl-6-hydroxy-4-(oxan-4-yl)-1,4-diazepan-4-ium-2-one Traditional Name: (6R)-1-cyclohexyl-6-hydroxy-4-tetrahydropyran-4-yl-1,4-diazepan-4-ium-2-one Formula: C16H29N2O3+ MolecularWeight: 297.41306

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(C[NH+](CC2=O)C3CCOCC3)O

Isomeric SMILES

C1CCC(CC1)N2C[C@H](C[NH+](CC2=O)C3CCOCC3)O

InChI

InChI=1S/C16H28N2O3/c19-15-10-17(13-6-8-21-9-7-13)12-16(20)18(11-15)14-4-2-1-3-5-14/h13-15,19H,1-12H2/p+1/t15-/m0/s1