3-(4-tert-butyl-3-methoxy-phenyl)carbonyl-2-(1,2-oxazol-3-yl)-4-(pyrazol-1-ylmethyl)-1,3-oxazolidine-4-carboxylic acid

Systemtic Name: 3-(4-tert-butyl-3-methoxy-phenyl)carbonyl-2-(1,2-oxazol-3-yl)-4-(pyrazol-1-ylmethyl)-1,3-oxazolidine-4-carboxylic acid Openeye Name: 3-(4-tert-butyl-3-methoxy-benzoyl)-2-isoxazol-3-yl-4-(pyrazol-1-ylmethyl)oxazolidine-4-carboxylic acid CAS Name: 3-[(4-tert-butyl-3-methoxyphenyl)-oxomethyl]-2-(3-isoxazolyl)-4-(1-pyrazolylmethyl)-4-oxazolidinecarboxylic acid IUPAC Name: 3-(4-tert-butyl-3-methoxybenzoyl)-2-(1,2-oxazol-3-yl)-4-(pyrazol-1-ylmethyl)-1,3-oxazolidine-4-carboxylic acid Traditional Name: 3-(4-tert-butyl-3-methoxy-benzoyl)-2-isoxazol-3-yl-4-(pyrazol-1-ylmethyl)oxazolidine-4-carboxylic acid Formula: C23H26N4O6 MolecularWeight: 454.47574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C(=O)N2C(OCC2(CN3C=CC=N3)C(=O)O)C4=NOC=C4)OC

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)C(=O)N2C(OCC2(CN3C=CC=N3)C(=O)O)C4=NOC=C4)OC

InChI

InChI=1S/C23H26N4O6/c1-22(2,3)16-7-6-15(12-18(16)31-4)19(28)27-20(17-8-11-33-25-17)32-14-23(27,21(29)30)13-26-10-5-9-24-26/h5-12,20H,13-14H2,1-4H3,(H,29,30)