5-(2-chloranyl-4-nitro-phenyl)-3-[2-oxidanylidene-2-(4-oxidanyl-4-phenyl-piperidin-1-yl)ethyl]-1,3,4-oxadiazol-2-one

Systemtic Name: 5-(2-chloranyl-4-nitro-phenyl)-3-[2-oxidanylidene-2-(4-oxidanyl-4-phenyl-piperidin-1-yl)ethyl]-1,3,4-oxadiazol-2-one Openeye Name: 5-(2-chloro-4-nitro-phenyl)-3-[2-(4-hydroxy-4-phenyl-1-piperidyl)-2-oxo-ethyl]-1,3,4-oxadiazol-2-one CAS Name: 5-(2-chloro-4-nitrophenyl)-3-[2-(4-hydroxy-4-phenyl-1-piperidinyl)-2-oxoethyl]-1,3,4-oxadiazol-2-one IUPAC Name: 5-(2-chloro-4-nitrophenyl)-3-[2-(4-hydroxy-4-phenylpiperidin-1-yl)-2-oxoethyl]-1,3,4-oxadiazol-2-one Traditional Name: 5-(2-chloro-4-nitro-phenyl)-3-[2-(4-hydroxy-4-phenyl-piperidino)-2-keto-ethyl]-1,3,4-oxadiazol-2-one Formula: C21H19ClN4O6 MolecularWeight: 458.85176

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)O)C(=O)CN3C(=O)OC(=N3)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)O)C(=O)CN3C(=O)OC(=N3)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H19ClN4O6/c22-17-12-15(26(30)31)6-7-16(17)19-23-25(20(28)32-19)13-18(27)24-10-8-21(29,9-11-24)14-4-2-1-3-5-14/h1-7,12,29H,8-11,13H2