(4-aminocarbonyl-2-nitro-phenyl)methyl 4-oxidanylidene-4-(4-pentoxyphenyl)butanoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 4-oxidanylidene-4-(4-pentoxyphenyl)butanoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 4-oxo-4-(4-pentoxyphenyl)butanoate CAS Name: 4-oxo-4-(4-pentoxyphenyl)butanoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 4-oxo-4-(4-pentoxyphenyl)butanoate Traditional Name: 4-(4-amoxyphenyl)-4-keto-butyric acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C23H26N2O7 MolecularWeight: 442.46174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)CCC(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)CCC(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C23H26N2O7/c1-2-3-4-13-31-19-9-7-16(8-10-19)21(26)11-12-22(27)32-15-18-6-5-17(23(24)28)14-20(18)25(29)30/h5-10,14H,2-4,11-13,15H2,1H3,(H2,24,28)