[5-[2-chloranyl-5-(2-methylpropyl)-1,3-thiazol-4-yl]furan-3-yl]phosphonic acid

Systemtic Name: [5-[2-chloranyl-5-(2-methylpropyl)-1,3-thiazol-4-yl]furan-3-yl]phosphonic acid Openeye Name: [5-(2-chloro-5-isobutyl-thiazol-4-yl)-3-furyl]phosphonic acid CAS Name: [5-[2-chloro-5-(2-methylpropyl)-4-thiazolyl]-3-furanyl]phosphonic acid IUPAC Name: [5-[2-chloro-5-(2-methylpropyl)-1,3-thiazol-4-yl]furan-3-yl]phosphonic acid Traditional Name: [5-(2-chloro-5-isobutyl-thiazol-4-yl)-3-furyl]phosphonic acid Formula: C11H13ClNO4PS MolecularWeight: 321.716981

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(N=C(S1)Cl)C2=CC(=CO2)P(=O)(O)O

Isomeric SMILES

CC(C)CC1=C(N=C(S1)Cl)C2=CC(=CO2)P(=O)(O)O

InChI

InChI=1S/C11H13ClNO4PS/c1-6(2)3-9-10(13-11(12)19-9)8-4-7(5-17-8)18(14,15)16/h4-6H,3H2,1-2H3,(H2,14,15,16)