4-[2-(2-thiophen-2-ylethanoylamino)phenoxy]phthalic acid

Systemtic Name: 4-[2-(2-thiophen-2-ylethanoylamino)phenoxy]phthalic acid Openeye Name: 4-[2-[[2-(2-thienyl)acetyl]amino]phenoxy]phthalic acid CAS Name: 4-[2-[(1-oxo-2-thiophen-2-ylethyl)amino]phenoxy]phthalic acid IUPAC Name: 4-[2-[(2-thiophen-2-ylacetyl)amino]phenoxy]phthalic acid Traditional Name: 4-[2-[[2-(2-thienyl)acetyl]amino]phenoxy]phthalic acid Formula: C20H15NO6S MolecularWeight: 397.4012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CC2=CC=CS2)OC3=CC(=C(C=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CC2=CC=CS2)OC3=CC(=C(C=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C20H15NO6S/c22-18(11-13-4-3-9-28-13)21-16-5-1-2-6-17(16)27-12-7-8-14(19(23)24)15(10-12)20(25)26/h1-10H,11H2,(H,21,22)(H,23,24)(H,25,26)