N-(5-chloranyl-2-oxidanyl-phenyl)-3-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide

Systemtic Name: N-(5-chloranyl-2-oxidanyl-phenyl)-3-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide Openeye Name: N-(5-chloro-2-hydroxy-phenyl)-3-(5-nitro-1,3-dioxo-isoindolin-2-yl)propanamide CAS Name: N-(5-chloro-2-hydroxyphenyl)-3-(5-nitro-1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-(5-chloro-2-hydroxyphenyl)-3-(5-nitro-1,3-dioxoisoindol-2-yl)propanamide Traditional Name: N-(5-chloro-2-hydroxy-phenyl)-3-(1,3-diketo-5-nitro-isoindolin-2-yl)propionamide Formula: C17H12ClN3O6 MolecularWeight: 389.74668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)CCC(=O)NC3=C(C=CC(=C3)Cl)O

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)CCC(=O)NC3=C(C=CC(=C3)Cl)O

InChI

InChI=1S/C17H12ClN3O6/c18-9-1-4-14(22)13(7-9)19-15(23)5-6-20-16(24)11-3-2-10(21(26)27)8-12(11)17(20)25/h1-4,7-8,22H,5-6H2,(H,19,23)