(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-(4-methylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-(4-methylpiperidin-1-yl)sulfonylbenzoate Openeye Name: (3-isopropyl-1,2,4-oxadiazol-5-yl)methyl 4-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-methylpiperidino)sulfonylbenzoic acid (3-isopropyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C19H25N3O5S MolecularWeight: 407.4839

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=NC(=NO3)C(C)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=NC(=NO3)C(C)C

InChI

InChI=1S/C19H25N3O5S/c1-13(2)18-20-17(27-21-18)12-26-19(23)15-4-6-16(7-5-15)28(24,25)22-10-8-14(3)9-11-22/h4-7,13-14H,8-12H2,1-3H3