3-(1,3-benzodioxol-5-yl)-5-[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]-1,2,4-oxadiazole

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-5-[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]-1,2,4-oxadiazole Openeye Name: 3-(1,3-benzodioxol-5-yl)-5-[1-(3-methoxyphenyl)sulfonyl-4-piperidyl]-1,2,4-oxadiazole CAS Name: 3-(1,3-benzodioxol-5-yl)-5-[1-(3-methoxyphenyl)sulfonyl-4-piperidinyl]-1,2,4-oxadiazole IUPAC Name: 3-(1,3-benzodioxol-5-yl)-5-[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]-1,2,4-oxadiazole Traditional Name: 3-(1,3-benzodioxol-5-yl)-5-[1-(3-methoxyphenyl)sulfonyl-4-piperidyl]-1,2,4-oxadiazole Formula: C21H21N3O6S MolecularWeight: 443.47294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C3=NC(=NO3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C3=NC(=NO3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H21N3O6S/c1-27-16-3-2-4-17(12-16)31(25,26)24-9-7-14(8-10-24)21-22-20(23-30-21)15-5-6-18-19(11-15)29-13-28-18/h2-6,11-12,14H,7-10,13H2,1H3