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2-ethyl-2-[ethyl-[4-nitro-2-(trifluoromethyl)phenyl]carbonyl-amino]pentanedioic acid

2-ethyl-2-[ethyl-[4-nitro-2-(trifluoromethyl)phenyl]carbonyl-amino]pentanedioic acid

Systemtic Name:2-ethyl-2-[ethyl-[4-nitro-2-(trifluoromethyl)phenyl]carbonyl-amino]pentanedioic acid
Openeye Name:2-ethyl-2-[ethyl-[4-nitro-2-(trifluoromethyl)benzoyl]amino]pentanedioic acid
CAS Name:2-ethyl-2-[ethyl-[[4-nitro-2-(trifluoromethyl)phenyl]-oxomethyl]amino]pentanedioic acid
IUPAC Name:2-ethyl-2-[ethyl-[4-nitro-2-(trifluoromethyl)benzoyl]amino]pentanedioic acid
Traditional Name:2-ethyl-2-[ethyl-[4-nitro-2-(trifluoromethyl)benzoyl]amino]glutaric acid
Formula: C17H19F3N2O7
MolecularWeight: 420.33717
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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(=O)O)(C(=O)O)N(CC)C(=O)C1=C(C=C(C=C1)[N+](=O)[O-])C(F)(F)F


Isomeric SMILES

CCC(CCC(=O)O)(C(=O)O)N(CC)C(=O)C1=C(C=C(C=C1)[N+](=O)[O-])C(F)(F)F


InChI

InChI=1S/C17H19F3N2O7/c1-3-16(15(26)27,8-7-13(23)24)21(4-2)14(25)11-6-5-10(22(28)29)9-12(11)17(18,19)20/h5-6,9H,3-4,7-8H2,1-2H3,(H,23,24)(H,26,27)


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