(3,3-dimethyl-2-oxidanylidene-butyl) 5-chloranyl-2-methoxy-4-(propanoylamino)benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 5-chloranyl-2-methoxy-4-(propanoylamino)benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 5-chloro-2-methoxy-4-(propanoylamino)benzoate CAS Name: 5-chloro-2-methoxy-4-(1-oxopropylamino)benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 5-chloro-2-methoxy-4-(propanoylamino)benzoate Traditional Name: 5-chloro-2-methoxy-4-propionamido-benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C17H22ClNO5 MolecularWeight: 355.81328

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=C(C(=C1)OC)C(=O)OCC(=O)C(C)(C)C)Cl

Isomeric SMILES

CCC(=O)NC1=C(C=C(C(=C1)OC)C(=O)OCC(=O)C(C)(C)C)Cl

InChI

InChI=1S/C17H22ClNO5/c1-6-15(21)19-12-8-13(23-5)10(7-11(12)18)16(22)24-9-14(20)17(2,3)4/h7-8H,6,9H2,1-5H3,(H,19,21)