tert-butyl 3-(4-chlorophenyl)-2-cyano-2-isocyano-propanoate

Systemtic Name: tert-butyl 3-(4-chlorophenyl)-2-cyano-2-isocyano-propanoate Openeye Name: tert-butyl 3-(4-chlorophenyl)-2-cyano-2-isocyano-propanoate CAS Name: 3-(4-chlorophenyl)-2-cyano-2-isocyanopropanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(4-chlorophenyl)-2-cyano-2-isocyanopropanoate Traditional Name: 3-(4-chlorophenyl)-2-cyano-2-isocyano-propionic acid tert-butyl ester Formula: C15H15ClN2O2 MolecularWeight: 290.7448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC=C(C=C1)Cl)(C#N)[N+]#[C-]

Isomeric SMILES

CC(C)(C)OC(=O)C(CC1=CC=C(C=C1)Cl)(C#N)[N+]#[C-]

InChI

InChI=1S/C15H15ClN2O2/c1-14(2,3)20-13(19)15(10-17,18-4)9-11-5-7-12(16)8-6-11/h5-8H,9H2,1-3H3