1-[2-oxidanylidene-2-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]ethyl]azepan-2-one

Systemtic Name: 1-[2-oxidanylidene-2-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]ethyl]azepan-2-one Openeye Name: 1-[2-oxo-2-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]piperazin-4-ium-1-yl]ethyl]azepan-2-one CAS Name: 1-[2-oxo-2-[4-[[(2R)-2-oxolanyl]methyl]-1-piperazin-4-iumyl]ethyl]-2-azepanone IUPAC Name: 1-[2-oxo-2-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]ethyl]azepan-2-one Traditional Name: 1-[2-keto-2-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]piperazin-4-ium-1-yl]ethyl]azepan-2-one Formula: C17H30N3O3+ MolecularWeight: 324.4384

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(=O)N2CC[NH+](CC2)CC3CCCO3

Isomeric SMILES

C1CCC(=O)N(CC1)CC(=O)N2CC[NH+](CC2)C[C@H]3CCCO3

InChI

InChI=1S/C17H29N3O3/c21-16-6-2-1-3-7-20(16)14-17(22)19-10-8-18(9-11-19)13-15-5-4-12-23-15/h15H,1-14H2/p+1/t15-/m1/s1