(5-chloranyl-2-methoxy-phenyl)methyl 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-3-carboxylate

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-3-carboxylate Openeye Name: (5-chloro-2-methoxy-phenyl)methyl 1-(3,5-dimethylisoxazol-4-yl)sulfonylpiperidine-3-carboxylate CAS Name: 1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-3-piperidinecarboxylic acid (5-chloro-2-methoxyphenyl)methyl ester IUPAC Name: (5-chloro-2-methoxyphenyl)methyl 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-3-carboxylate Traditional Name: 1-(3,5-dimethylisoxazol-4-yl)sulfonylnipecotic acid (5-chloro-2-methoxy-benzyl) ester Formula: C19H23ClN2O6S MolecularWeight: 442.91372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCC(C2)C(=O)OCC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCC(C2)C(=O)OCC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C19H23ClN2O6S/c1-12-18(13(2)28-21-12)29(24,25)22-8-4-5-14(10-22)19(23)27-11-15-9-16(20)6-7-17(15)26-3/h6-7,9,14H,4-5,8,10-11H2,1-3H3