3-(2-ethoxyphenyl)-5-[4-(2-methylpiperidin-1-yl)-3-nitro-phenyl]-1,2,4-oxadiazole

Systemtic Name: 3-(2-ethoxyphenyl)-5-[4-(2-methylpiperidin-1-yl)-3-nitro-phenyl]-1,2,4-oxadiazole Openeye Name: 3-(2-ethoxyphenyl)-5-[4-(2-methyl-1-piperidyl)-3-nitro-phenyl]-1,2,4-oxadiazole CAS Name: 3-(2-ethoxyphenyl)-5-[4-(2-methyl-1-piperidinyl)-3-nitrophenyl]-1,2,4-oxadiazole IUPAC Name: 3-(2-ethoxyphenyl)-5-[4-(2-methylpiperidin-1-yl)-3-nitrophenyl]-1,2,4-oxadiazole Traditional Name: 5-[4-(2-methylpiperidino)-3-nitro-phenyl]-3-o-phenetyl-1,2,4-oxadiazole Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NOC(=N2)C3=CC(=C(C=C3)N4CCCCC4C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1C2=NOC(=N2)C3=CC(=C(C=C3)N4CCCCC4C)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O4/c1-3-29-20-10-5-4-9-17(20)21-23-22(30-24-21)16-11-12-18(19(14-16)26(27)28)25-13-7-6-8-15(25)2/h4-5,9-12,14-15H,3,6-8,13H2,1-2H3