2-(4-azanyl-2,3,5-triethyl-phenyl)-2-ethyl-propane-1,1,3,3-tetracarboxylate

Systemtic Name: 2-(4-azanyl-2,3,5-triethyl-phenyl)-2-ethyl-propane-1,1,3,3-tetracarboxylate Openeye Name: 2-(4-amino-2,3,5-triethyl-phenyl)-2-ethyl-propane-1,1,3,3-tetracarboxylate CAS Name: 2-(4-amino-2,3,5-triethylphenyl)-2-ethylpropane-1,1,3,3-tetracarboxylate IUPAC Name: 2-(4-amino-2,3,5-triethylphenyl)-2-ethylpropane-1,1,3,3-tetracarboxylate Traditional Name: 2-(4-amino-2,3,5-triethyl-phenyl)-2-ethyl-propane-1,1,3,3-tetracarboxylate Formula: C21H25NO8-4 MolecularWeight: 419.4251

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C(=C1)C(CC)(C(C(=O)[O-])C(=O)[O-])C(C(=O)[O-])C(=O)[O-])CC)CC)N

Isomeric SMILES

CCC1=C(C(=C(C(=C1)C(CC)(C(C(=O)[O-])C(=O)[O-])C(C(=O)[O-])C(=O)[O-])CC)CC)N

InChI

InChI=1S/C21H29NO8/c1-5-10-9-13(11(6-2)12(7-3)16(10)22)21(8-4,14(17(23)24)18(25)26)15(19(27)28)20(29)30/h9,14-15H,5-8,22H2,1-4H3,(H,23,24)(H,25,26)(H,27,28)(H,29,30)/p-4