methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexa-1,5-diene-1-carboxylate

Systemtic Name: methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexa-1,5-diene-1-carboxylate Openeye Name: methyl 3-(tert-butoxycarbonylamino)cyclohexa-1,5-diene-1-carboxylate CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-cyclohexa-1,5-dienecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexa-1,5-diene-1-carboxylate Traditional Name: 3-(tert-butoxycarbonylamino)cyclohexa-1,5-diene-1-carboxylic acid methyl ester Formula: C13H19NO4 MolecularWeight: 253.29426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CC=CC(=C1)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1CC=CC(=C1)C(=O)OC

InChI

InChI=1S/C13H19NO4/c1-13(2,3)18-12(16)14-10-7-5-6-9(8-10)11(15)17-4/h5-6,8,10H,7H2,1-4H3,(H,14,16)