[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-piperidin-1-ylsulfonylbenzoate

Systemtic Name: [3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-piperidin-1-ylsulfonylbenzoate Openeye Name: [3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-(1-piperidylsulfonyl)benzoate CAS Name: 2-(1-piperidinylsulfonyl)benzoic acid [3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-piperidinosulfonylbenzoic acid [3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C22H23N3O6S MolecularWeight: 457.49952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC=CC=C3S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC=CC=C3S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H23N3O6S/c1-29-17-11-9-16(10-12-17)21-23-20(31-24-21)15-30-22(26)18-7-3-4-8-19(18)32(27,28)25-13-5-2-6-14-25/h3-4,7-12H,2,5-6,13-15H2,1H3