2-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]butanedioic acid

Systemtic Name: 2-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]butanedioic acid Openeye Name: 2-[2-(4-chlorophenyl)thiazol-4-yl]butanedioic acid CAS Name: 2-[2-(4-chlorophenyl)-4-thiazolyl]butanedioic acid IUPAC Name: 2-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]butanedioic acid Traditional Name: 2-[2-(4-chlorophenyl)thiazol-4-yl]succinic acid Formula: C13H10ClNO4S MolecularWeight: 311.7408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=CS2)C(CC(=O)O)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=CS2)C(CC(=O)O)C(=O)O)Cl

InChI

InChI=1S/C13H10ClNO4S/c14-8-3-1-7(2-4-8)12-15-10(6-20-12)9(13(18)19)5-11(16)17/h1-4,6,9H,5H2,(H,16,17)(H,18,19)