tert-butyl carbamate; 2-cyclohexa-1,4-dien-1-ylpropanoic acid

Systemtic Name: tert-butyl carbamate; 2-cyclohexa-1,4-dien-1-ylpropanoic acid Openeye Name: tert-butyl carbamate; 2-cyclohexa-1,4-dien-1-ylpropanoic acid CAS Name: carbamic acid tert-butyl ester; 2-(1-cyclohexa-1,4-dienyl)propanoic acid IUPAC Name: tert-butyl carbamate; 2-cyclohexa-1,4-dien-1-ylpropanoic acid Traditional Name: carbamic acid tert-butyl ester; 2-cyclohexa-1,4-dien-1-ylpropionic acid Formula: C14H23NO4 MolecularWeight: 269.33672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CCC=CC1)C(=O)O.CC(C)(C)OC(=O)N

Isomeric SMILES

CC(C1=CCC=CC1)C(=O)O.CC(C)(C)OC(=O)N

InChI

InChI=1S/C9H12O2.C5H11NO2/c1-7(9(10)11)8-5-3-2-4-6-8;1-5(2,3)8-4(6)7/h2-3,6-7H,4-5H2,1H3,(H,10,11);1-3H3,(H2,6,7)