N-[[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[[5-(4-methoxyphenyl)isoxazol-3-yl]methyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[[5-(4-methoxyphenyl)-3-isoxazolyl]methyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: 1-mesyl-N-[[5-(4-methoxyphenyl)isoxazol-3-yl]methyl]isonipecotamide Formula: C18H23N3O5S MolecularWeight: 393.45732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NO2)CNC(=O)C3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NO2)CNC(=O)C3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C18H23N3O5S/c1-25-16-5-3-13(4-6-16)17-11-15(20-26-17)12-19-18(22)14-7-9-21(10-8-14)27(2,23)24/h3-6,11,14H,7-10,12H2,1-2H3,(H,19,22)