tert-butyl 2-[(2-tert-butyl-4-chloranyl-1,3-benzoxazol-7-yl)carbonyl]-3-cyclopropyl-3-oxidanylidene-propanoate

Systemtic Name: tert-butyl 2-[(2-tert-butyl-4-chloranyl-1,3-benzoxazol-7-yl)carbonyl]-3-cyclopropyl-3-oxidanylidene-propanoate Openeye Name: tert-butyl 2-(2-tert-butyl-4-chloro-1,3-benzoxazole-7-carbonyl)-3-cyclopropyl-3-oxo-propanoate CAS Name: 2-[(2-tert-butyl-4-chloro-1,3-benzoxazol-7-yl)-oxomethyl]-3-cyclopropyl-3-oxopropanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(2-tert-butyl-4-chloro-1,3-benzoxazole-7-carbonyl)-3-cyclopropyl-3-oxopropanoate Traditional Name: 2-(2-tert-butyl-4-chloro-1,3-benzoxazole-7-carbonyl)-3-cyclopropyl-3-keto-propionic acid tert-butyl ester Formula: C22H26ClNO5 MolecularWeight: 419.89854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(C=CC(=C2O1)C(=O)C(C(=O)C3CC3)C(=O)OC(C)(C)C)Cl

Isomeric SMILES

CC(C)(C)C1=NC2=C(C=CC(=C2O1)C(=O)C(C(=O)C3CC3)C(=O)OC(C)(C)C)Cl

InChI

InChI=1S/C22H26ClNO5/c1-21(2,3)20-24-15-13(23)10-9-12(18(15)28-20)17(26)14(16(25)11-7-8-11)19(27)29-22(4,5)6/h9-11,14H,7-8H2,1-6H3