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

Systemtic Name: 3-(3,4-dimethoxyphenyl)-5-[4-(3-methylpiperidin-1-yl)-3-nitro-phenyl]-1,2,4-oxadiazole Openeye Name: 3-(3,4-dimethoxyphenyl)-5-[4-(3-methyl-1-piperidyl)-3-nitro-phenyl]-1,2,4-oxadiazole CAS Name: 3-(3,4-dimethoxyphenyl)-5-[4-(3-methyl-1-piperidinyl)-3-nitrophenyl]-1,2,4-oxadiazole IUPAC Name: 3-(3,4-dimethoxyphenyl)-5-[4-(3-methylpiperidin-1-yl)-3-nitrophenyl]-1,2,4-oxadiazole Traditional Name: 3-(3,4-dimethoxyphenyl)-5-[4-(3-methylpiperidino)-3-nitro-phenyl]-1,2,4-oxadiazole Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C3=NC(=NO3)C4=CC(=C(C=C4)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C3=NC(=NO3)C4=CC(=C(C=C4)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O5/c1-14-5-4-10-25(13-14)17-8-6-16(11-18(17)26(27)28)22-23-21(24-31-22)15-7-9-19(29-2)20(12-15)30-3/h6-9,11-12,14H,4-5,10,13H2,1-3H3