tert-butyl N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate; 4-methylbenzenecarbonitrile

Systemtic Name: tert-butyl N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate; 4-methylbenzenecarbonitrile Openeye Name: tert-butyl N-tert-butoxycarbonylcarbamate; 4-methylbenzonitrile CAS Name: 4-methylbenzonitrile; N-[(2-methylpropan-2-yl)oxy-oxomethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate; 4-methylbenzonitrile Traditional Name: N-tert-butoxycarbonylcarbamic acid tert-butyl ester; 4-methylbenzonitrile Formula: C18H26N2O4 MolecularWeight: 334.41004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#N.CC(C)(C)OC(=O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C#N.CC(C)(C)OC(=O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C10H19NO4.C8H7N/c1-9(2,3)14-7(12)11-8(13)15-10(4,5)6;1-7-2-4-8(6-9)5-3-7/h1-6H3,(H,11,12,13);2-5H,1H3