[1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl] 3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoate

Systemtic Name: [1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl] 3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoate Openeye Name: [1-methyl-2-oxo-2-[4-(1-piperidylsulfonyl)anilino]ethyl] 3-(3,5-dimethylisoxazol-4-yl)propanoate CAS Name: 3-(3,5-dimethyl-4-isoxazolyl)propanoic acid [1-oxo-1-[4-(1-piperidinylsulfonyl)anilino]propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-piperidin-1-ylsulfonylanilino)propan-2-yl] 3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoate Traditional Name: 3-(3,5-dimethylisoxazol-4-yl)propionic acid [2-keto-1-methyl-2-(4-piperidinosulfonylanilino)ethyl] ester Formula: C22H29N3O6S MolecularWeight: 463.54716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CCC(=O)OC(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C(=NO1)C)CCC(=O)OC(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H29N3O6S/c1-15-20(16(2)31-24-15)11-12-21(26)30-17(3)22(27)23-18-7-9-19(10-8-18)32(28,29)25-13-5-4-6-14-25/h7-10,17H,4-6,11-14H2,1-3H3,(H,23,27)