2-chloranyl-4-nitro-N-[2-oxidanyl-2-(3,4,5-trimethoxyphenyl)ethyl]benzamide

Systemtic Name: 2-chloranyl-4-nitro-N-[2-oxidanyl-2-(3,4,5-trimethoxyphenyl)ethyl]benzamide Openeye Name: 2-chloro-N-[2-hydroxy-2-(3,4,5-trimethoxyphenyl)ethyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[2-hydroxy-2-(3,4,5-trimethoxyphenyl)ethyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[2-hydroxy-2-(3,4,5-trimethoxyphenyl)ethyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[2-hydroxy-2-(3,4,5-trimethoxyphenyl)ethyl]-4-nitro-benzamide Formula: C18H19ClN2O7 MolecularWeight: 410.80566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)O

InChI

InChI=1S/C18H19ClN2O7/c1-26-15-6-10(7-16(27-2)17(15)28-3)14(22)9-20-18(23)12-5-4-11(21(24)25)8-13(12)19/h4-8,14,22H,9H2,1-3H3,(H,20,23)