tert-butyl 4-isocyanato-3-methoxy-benzoate

Systemtic Name: tert-butyl 4-isocyanato-3-methoxy-benzoate Openeye Name: tert-butyl 4-isocyanato-3-methoxy-benzoate CAS Name: 4-isocyanato-3-methoxybenzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-isocyanato-3-methoxybenzoate Traditional Name: 4-isocyanato-3-methoxy-benzoic acid tert-butyl ester Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C=C1)N=C=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C=C1)N=C=O)OC

InChI

InChI=1S/C13H15NO4/c1-13(2,3)18-12(16)9-5-6-10(14-8-15)11(7-9)17-4/h5-7H,1-4H3