5-(2,2-dimethylbutanoylamino)-2-(prop-2-enoxymethoxy)benzoic acid

Systemtic Name: 5-(2,2-dimethylbutanoylamino)-2-(prop-2-enoxymethoxy)benzoic acid Openeye Name: 2-(allyloxymethoxy)-5-(2,2-dimethylbutanoylamino)benzoic acid CAS Name: 5-[(2,2-dimethyl-1-oxobutyl)amino]-2-(prop-2-enoxymethoxy)benzoic acid IUPAC Name: 5-(2,2-dimethylbutanoylamino)-2-(prop-2-enoxymethoxy)benzoic acid Traditional Name: 2-(allyloxymethoxy)-5-(2,2-dimethylbutanoylamino)benzoic acid Formula: C17H23NO5 MolecularWeight: 321.36822

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)NC1=CC(=C(C=C1)OCOCC=C)C(=O)O

Isomeric SMILES

CCC(C)(C)C(=O)NC1=CC(=C(C=C1)OCOCC=C)C(=O)O

InChI

InChI=1S/C17H23NO5/c1-5-9-22-11-23-14-8-7-12(10-13(14)15(19)20)18-16(21)17(3,4)6-2/h5,7-8,10H,1,6,9,11H2,2-4H3,(H,18,21)(H,19,20)