ethyl 4-[(3,4-ditert-butylpyridin-2-yl)carbamoyl]-2-fluoranyl-benzoate

Systemtic Name: ethyl 4-[(3,4-ditert-butylpyridin-2-yl)carbamoyl]-2-fluoranyl-benzoate Openeye Name: ethyl 4-[(3,4-ditert-butyl-2-pyridyl)carbamoyl]-2-fluoro-benzoate CAS Name: 4-[[(3,4-ditert-butyl-2-pyridinyl)amino]-oxomethyl]-2-fluorobenzoic acid ethyl ester IUPAC Name: ethyl 4-[(3,4-ditert-butylpyridin-2-yl)carbamoyl]-2-fluorobenzoate Traditional Name: 4-[(3,4-ditert-butyl-2-pyridyl)carbamoyl]-2-fluoro-benzoic acid ethyl ester Formula: C23H29FN2O3 MolecularWeight: 400.486363

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1)C(=O)NC2=NC=CC(=C2C(C)(C)C)C(C)(C)C)F

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1)C(=O)NC2=NC=CC(=C2C(C)(C)C)C(C)(C)C)F

InChI

InChI=1S/C23H29FN2O3/c1-8-29-21(28)15-10-9-14(13-17(15)24)20(27)26-19-18(23(5,6)7)16(11-12-25-19)22(2,3)4/h9-13H,8H2,1-7H3,(H,25,26,27)