N-[[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[[5-(4-methoxyphenyl)isoxazol-3-yl]methyl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[[5-(4-methoxyphenyl)-3-isoxazolyl]methyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[[5-(4-methoxyphenyl)isoxazol-3-yl]methyl]-4-piperidinosulfonyl-benzamide Formula: C23H25N3O5S MolecularWeight: 455.5267

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NO2)CNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NO2)CNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H25N3O5S/c1-30-20-9-5-17(6-10-20)22-15-19(25-31-22)16-24-23(27)18-7-11-21(12-8-18)32(28,29)26-13-3-2-4-14-26/h5-12,15H,2-4,13-14,16H2,1H3,(H,24,27)