3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexa-1,5-diene-1-carboxylic acid

Systemtic Name: 3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexa-1,5-diene-1-carboxylic acid Openeye Name: 3-(tert-butoxycarbonylamino)cyclohexa-1,5-diene-1-carboxylic acid CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-cyclohexa-1,5-dienecarboxylic acid IUPAC Name: 3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexa-1,5-diene-1-carboxylic acid Traditional Name: 3-(tert-butoxycarbonylamino)cyclohexa-1,5-diene-1-carboxylic acid Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO4/c1-12(2,3)17-11(16)13-9-6-4-5-8(7-9)10(14)15/h4-5,7,9H,6H2,1-3H3,(H,13,16)(H,14,15)