(3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-piperidin-1-ylsulfonylbenzoate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-piperidin-1-ylsulfonylbenzoate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 4-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinylsulfonyl)benzoic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidinosulfonylbenzoic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C(=NO1)C)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H22N2O5S/c1-13-17(14(2)25-19-13)12-24-18(21)15-6-8-16(9-7-15)26(22,23)20-10-4-3-5-11-20/h6-9H,3-5,10-12H2,1-2H3