2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethanoic acid

Systemtic Name: 2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethanoic acid Openeye Name: 2-[4-(3-nitrophenyl)thiazol-2-yl]acetic acid CAS Name: 2-[4-(3-nitrophenyl)-2-thiazolyl]acetic acid IUPAC Name: 2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]acetic acid Traditional Name: 2-[4-(3-nitrophenyl)thiazol-2-yl]acetic acid Formula: C11H8N2O4S MolecularWeight: 264.25722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)CC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)CC(=O)O

InChI

InChI=1S/C11H8N2O4S/c14-11(15)5-10-12-9(6-18-10)7-2-1-3-8(4-7)13(16)17/h1-4,6H,5H2,(H,14,15)