5-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]carbonyloxolan-2-one

Systemtic Name: 5-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]carbonyloxolan-2-one Openeye Name: 5-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidine-1-carbonyl]tetrahydrofuran-2-one CAS Name: 5-[[4-[1-(1-benzotriazolylmethyl)-2-imidazolyl]-1-piperidinyl]-oxomethyl]-2-oxolanone IUPAC Name: 5-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidine-1-carbonyl]oxolan-2-one Traditional Name: 5-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidine-1-carbonyl]tetrahydrofuran-2-one Formula: C20H22N6O3 MolecularWeight: 394.42708

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)OC1C(=O)N2CCC(CC2)C3=NC=CN3CN4C5=CC=CC=C5N=N4

Isomeric SMILES

C1CC(=O)OC1C(=O)N2CCC(CC2)C3=NC=CN3CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C20H22N6O3/c27-18-6-5-17(29-18)20(28)24-10-7-14(8-11-24)19-21-9-12-25(19)13-26-16-4-2-1-3-15(16)22-23-26/h1-4,9,12,14,17H,5-8,10-11,13H2