ethyl (E)-3-[2-chloranyl-4-fluoranyl-5-(5-oxidanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[2-chloranyl-4-fluoranyl-5-(5-oxidanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[2-chloro-4-fluoro-5-(5-oxo-2H-tetrazol-1-yl)phenyl]prop-2-enoate CAS Name: (E)-3-[2-chloro-4-fluoro-5-(5-oxo-2H-tetrazol-1-yl)phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[2-chloro-4-fluoro-5-(5-oxo-2H-tetrazol-1-yl)phenyl]prop-2-enoate Traditional Name: (E)-3-[2-chloro-4-fluoro-5-(5-keto-2H-tetrazol-1-yl)phenyl]acrylic acid ethyl ester Formula: C12H10ClFN4O3 MolecularWeight: 312.684203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC(=C(C=C1Cl)F)N2C(=O)N=NN2

Isomeric SMILES

CCOC(=O)/C=C/C1=CC(=C(C=C1Cl)F)N2C(=O)N=NN2

InChI

InChI=1S/C12H10ClFN4O3/c1-2-21-11(19)4-3-7-5-10(9(14)6-8(7)13)18-12(20)15-16-17-18/h3-6H,2H2,1H3,(H,15,17,20)/b4-3+