3,4,5-triethoxy-N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]benzamide

Systemtic Name: 3,4,5-triethoxy-N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]benzamide Openeye Name: 3,4,5-triethoxy-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]benzamide CAS Name: 3,4,5-triethoxy-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]benzamide IUPAC Name: 3,4,5-triethoxy-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]benzamide Traditional Name: 3,4,5-triethoxy-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]benzamide Formula: C21H26N2O7 MolecularWeight: 418.44034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C21H26N2O7/c1-4-28-18-11-15(12-19(29-5-2)20(18)30-6-3)21(25)22-13-17(24)14-7-9-16(10-8-14)23(26)27/h7-12,17,24H,4-6,13H2,1-3H3,(H,22,25)