3-azanyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexene-1,2-dicarboxylic acid

Systemtic Name: 3-azanyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexene-1,2-dicarboxylic acid Openeye Name: 3-amino-3-(tert-butoxycarbonylamino)cyclohexene-1,2-dicarboxylic acid CAS Name: 3-amino-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]cyclohexene-1,2-dicarboxylic acid IUPAC Name: 3-amino-3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexene-1,2-dicarboxylic acid Traditional Name: 3-amino-3-(tert-butoxycarbonylamino)cyclohexene-1,2-dicarboxylic acid Formula: C13H20N2O6 MolecularWeight: 300.3077

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1(CCCC(=C1C(=O)O)C(=O)O)N

Isomeric SMILES

CC(C)(C)OC(=O)NC1(CCCC(=C1C(=O)O)C(=O)O)N

InChI

InChI=1S/C13H20N2O6/c1-12(2,3)21-11(20)15-13(14)6-4-5-7(9(16)17)8(13)10(18)19/h4-6,14H2,1-3H3,(H,15,20)(H,16,17)(H,18,19)