4-[4-(2-methylbutanoylamino)phenoxy]phthalic acid

Systemtic Name: 4-[4-(2-methylbutanoylamino)phenoxy]phthalic acid Openeye Name: 4-[4-(2-methylbutanoylamino)phenoxy]phthalic acid CAS Name: 4-[4-[(2-methyl-1-oxobutyl)amino]phenoxy]phthalic acid IUPAC Name: 4-[4-(2-methylbutanoylamino)phenoxy]phthalic acid Traditional Name: 4-[4-(2-methylbutanoylamino)phenoxy]phthalic acid Formula: C19H19NO6 MolecularWeight: 357.35726

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)NC1=CC=C(C=C1)OC2=CC(=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

CCC(C)C(=O)NC1=CC=C(C=C1)OC2=CC(=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C19H19NO6/c1-3-11(2)17(21)20-12-4-6-13(7-5-12)26-14-8-9-15(18(22)23)16(10-14)19(24)25/h4-11H,3H2,1-2H3,(H,20,21)(H,22,23)(H,24,25)