5-(5-ethoxy-2-methyl-5-oxidanylidene-pentan-2-yl)oxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 5-(5-ethoxy-2-methyl-5-oxidanylidene-pentan-2-yl)oxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 5-(4-ethoxy-1,1-dimethyl-4-oxo-butoxy)carbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 5-[(5-ethoxy-2-methyl-5-oxopentan-2-yl)oxy-oxomethyl]-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 5-(5-ethoxy-2-methyl-5-oxopentan-2-yl)oxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-(4-ethoxy-4-keto-1,1-dimethyl-butoxy)carbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C23H28N2O8 MolecularWeight: 460.47702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C)(C)OC(=O)C1=C(NC(=C(C1C2=CC=CC=C2[N+](=O)[O-])C(=O)O)C)C

Isomeric SMILES

CCOC(=O)CCC(C)(C)OC(=O)C1=C(NC(=C(C1C2=CC=CC=C2[N+](=O)[O-])C(=O)O)C)C

InChI

InChI=1S/C23H28N2O8/c1-6-32-17(26)11-12-23(4,5)33-22(29)19-14(3)24-13(2)18(21(27)28)20(19)15-9-7-8-10-16(15)25(30)31/h7-10,20,24H,6,11-12H2,1-5H3,(H,27,28)