5-[4-(2-ethylpiperidin-1-yl)-3-nitro-phenyl]-3-pyridin-3-yl-1,2,4-oxadiazole

Systemtic Name: 5-[4-(2-ethylpiperidin-1-yl)-3-nitro-phenyl]-3-pyridin-3-yl-1,2,4-oxadiazole Openeye Name: 5-[4-(2-ethyl-1-piperidyl)-3-nitro-phenyl]-3-(3-pyridyl)-1,2,4-oxadiazole CAS Name: 5-[4-(2-ethyl-1-piperidinyl)-3-nitrophenyl]-3-(3-pyridinyl)-1,2,4-oxadiazole IUPAC Name: 5-[4-(2-ethylpiperidin-1-yl)-3-nitrophenyl]-3-pyridin-3-yl-1,2,4-oxadiazole Traditional Name: 5-[4-(2-ethylpiperidino)-3-nitro-phenyl]-3-(3-pyridyl)-1,2,4-oxadiazole Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=C(C=C(C=C2)C3=NC(=NO3)C4=CN=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCC1CCCCN1C2=C(C=C(C=C2)C3=NC(=NO3)C4=CN=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O3/c1-2-16-7-3-4-11-24(16)17-9-8-14(12-18(17)25(26)27)20-22-19(23-28-20)15-6-5-10-21-13-15/h5-6,8-10,12-13,16H,2-4,7,11H2,1H3