[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl 2-methoxy-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl 2-methoxy-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: [5-(p-tolyl)-1,2,4-oxadiazol-3-yl]methyl 2-methoxy-5-morpholinosulfonyl-benzoate CAS Name: 2-methoxy-5-(4-morpholinylsulfonyl)benzoic acid [5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl ester IUPAC Name: [5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl 2-methoxy-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-methoxy-5-morpholinosulfonyl-benzoic acid [5-(p-tolyl)-1,2,4-oxadiazol-3-yl]methyl ester Formula: C22H23N3O7S MolecularWeight: 473.49892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NO2)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NO2)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)OC

InChI

InChI=1S/C22H23N3O7S/c1-15-3-5-16(6-4-15)21-23-20(24-32-21)14-31-22(26)18-13-17(7-8-19(18)29-2)33(27,28)25-9-11-30-12-10-25/h3-8,13H,9-12,14H2,1-2H3