2-[[4-(2,2-dimethylpropanoyl)phenyl]carbonyl-ethoxycarbonyl-amino]-5-ethoxy-benzoic acid

Systemtic Name: 2-[[4-(2,2-dimethylpropanoyl)phenyl]carbonyl-ethoxycarbonyl-amino]-5-ethoxy-benzoic acid Openeye Name: 2-[[4-(2,2-dimethylpropanoyl)benzoyl]-ethoxycarbonyl-amino]-5-ethoxy-benzoic acid CAS Name: 2-[[[4-(2,2-dimethyl-1-oxopropyl)phenyl]-oxomethyl]-ethoxycarbonylamino]-5-ethoxybenzoic acid IUPAC Name: 2-[[4-(2,2-dimethylpropanoyl)benzoyl]-ethoxycarbonylamino]-5-ethoxybenzoic acid Traditional Name: 2-[carbethoxy-(4-pivaloylbenzoyl)amino]-5-ethoxy-benzoic acid Formula: C24H27NO7 MolecularWeight: 441.47368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)N(C(=O)C2=CC=C(C=C2)C(=O)C(C)(C)C)C(=O)OCC)C(=O)O

Isomeric SMILES

CCOC1=CC(=C(C=C1)N(C(=O)C2=CC=C(C=C2)C(=O)C(C)(C)C)C(=O)OCC)C(=O)O

InChI

InChI=1S/C24H27NO7/c1-6-31-17-12-13-19(18(14-17)22(28)29)25(23(30)32-7-2)21(27)16-10-8-15(9-11-16)20(26)24(3,4)5/h8-14H,6-7H2,1-5H3,(H,28,29)