5-chloranyl-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-oxidanyl-benzamide

Systemtic Name: 5-chloranyl-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-oxidanyl-benzamide Openeye Name: 5-chloro-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-hydroxy-benzamide CAS Name: 5-chloro-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2-hydroxybenzamide IUPAC Name: 5-chloro-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2-hydroxybenzamide Traditional Name: 5-chloro-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-hydroxy-benzamide Formula: C17H17ClN2O6 MolecularWeight: 380.77968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)C2=C(C=CC(=C2)Cl)O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)C2=C(C=CC(=C2)Cl)O)[N+](=O)[O-])OC

InChI

InChI=1S/C17H17ClN2O6/c1-25-15-7-10(13(20(23)24)9-16(15)26-2)5-6-19-17(22)12-8-11(18)3-4-14(12)21/h3-4,7-9,21H,5-6H2,1-2H3,(H,19,22)