tert-butyl 3-azanyl-4-cyano-benzoate

Systemtic Name: tert-butyl 3-azanyl-4-cyano-benzoate Openeye Name: tert-butyl 3-amino-4-cyano-benzoate CAS Name: 3-amino-4-cyanobenzoic acid tert-butyl ester IUPAC Name: tert-butyl 3-amino-4-cyanobenzoate Traditional Name: 3-amino-4-cyano-benzoic acid tert-butyl ester Formula: C12H14N2O2 MolecularWeight: 218.25176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O2/c1-12(2,3)16-11(15)8-4-5-9(7-13)10(14)6-8/h4-6H,14H2,1-3H3