(5-methyl-1,2-oxazol-3-yl)methyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate

Systemtic Name: (5-methyl-1,2-oxazol-3-yl)methyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Openeye Name: (5-methylisoxazol-3-yl)methyl 3-[4-(1-piperidylsulfonyl)phenyl]propanoate CAS Name: 3-[4-(1-piperidinylsulfonyl)phenyl]propanoic acid (5-methyl-3-isoxazolyl)methyl ester IUPAC Name: (5-methyl-1,2-oxazol-3-yl)methyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-piperidinosulfonylphenyl)propionic acid (5-methylisoxazol-3-yl)methyl ester Formula: C19H24N2O5S MolecularWeight: 392.46926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)COC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC(=NO1)COC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H24N2O5S/c1-15-13-17(20-26-15)14-25-19(22)10-7-16-5-8-18(9-6-16)27(23,24)21-11-3-2-4-12-21/h5-6,8-9,13H,2-4,7,10-12,14H2,1H3