tert-butyl 2-[2-chloranyl-4-(methylsulfonylamino)phenyl]carbonyl-3-cyclopropyl-3-oxidanylidene-propanoate

Systemtic Name: tert-butyl 2-[2-chloranyl-4-(methylsulfonylamino)phenyl]carbonyl-3-cyclopropyl-3-oxidanylidene-propanoate Openeye Name: tert-butyl 2-[2-chloro-4-(methanesulfonamido)benzoyl]-3-cyclopropyl-3-oxo-propanoate CAS Name: 2-[[2-chloro-4-(methanesulfonamido)phenyl]-oxomethyl]-3-cyclopropyl-3-oxopropanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-chloro-4-(methanesulfonamido)benzoyl]-3-cyclopropyl-3-oxopropanoate Traditional Name: 2-[2-chloro-4-(methanesulfonamido)benzoyl]-3-cyclopropyl-3-keto-propionic acid tert-butyl ester Formula: C18H22ClNO6S MolecularWeight: 415.88838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C(=O)C1CC1)C(=O)C2=C(C=C(C=C2)NS(=O)(=O)C)Cl

Isomeric SMILES

CC(C)(C)OC(=O)C(C(=O)C1CC1)C(=O)C2=C(C=C(C=C2)NS(=O)(=O)C)Cl

InChI

InChI=1S/C18H22ClNO6S/c1-18(2,3)26-17(23)14(15(21)10-5-6-10)16(22)12-8-7-11(9-13(12)19)20-27(4,24)25/h7-10,14,20H,5-6H2,1-4H3