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

Systemtic Name: [5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methyl 4-piperidin-1-ylsulfonylbenzoate Openeye Name: [5-(3-methoxyphenyl)isoxazol-3-yl]methyl 4-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinylsulfonyl)benzoic acid [5-(3-methoxyphenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methyl 4-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidinosulfonylbenzoic acid [5-(3-methoxyphenyl)isoxazol-3-yl]methyl ester Formula: C23H24N2O6S MolecularWeight: 456.51146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24N2O6S/c1-29-20-7-5-6-18(14-20)22-15-19(24-31-22)16-30-23(26)17-8-10-21(11-9-17)32(27,28)25-12-3-2-4-13-25/h5-11,14-15H,2-4,12-13,16H2,1H3