tert-butyl N-[2-[1-(cyanomethyl)cyclohexa-2,5-dien-1-yl]phenyl]carbamate

Systemtic Name: tert-butyl N-[2-[1-(cyanomethyl)cyclohexa-2,5-dien-1-yl]phenyl]carbamate Openeye Name: tert-butyl N-[2-[1-(cyanomethyl)cyclohexa-2,5-dien-1-yl]phenyl]carbamate CAS Name: N-[2-[1-(cyanomethyl)-1-cyclohexa-2,5-dienyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[1-(cyanomethyl)cyclohexa-2,5-dien-1-yl]phenyl]carbamate Traditional Name: N-[2-[1-(cyanomethyl)cyclohexa-2,5-dien-1-yl]phenyl]carbamic acid tert-butyl ester Formula: C19H22N2O2 MolecularWeight: 310.39018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC=C1C2(C=CCC=C2)CC#N

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC=C1C2(C=CCC=C2)CC#N

InChI

InChI=1S/C19H22N2O2/c1-18(2,3)23-17(22)21-16-10-6-5-9-15(16)19(13-14-20)11-7-4-8-12-19/h5-12H,4,13H2,1-3H3,(H,21,22)