6-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(5-chloranyl-2-methoxy-4-nitro-phenyl)hexanamide

Systemtic Name: 6-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(5-chloranyl-2-methoxy-4-nitro-phenyl)hexanamide Openeye Name: N-(5-chloro-2-methoxy-4-nitro-phenyl)-6-(1,3-dioxoisoindolin-2-yl)hexanamide CAS Name: N-(5-chloro-2-methoxy-4-nitrophenyl)-6-(1,3-dioxo-2-isoindolyl)hexanamide IUPAC Name: N-(5-chloro-2-methoxy-4-nitrophenyl)-6-(1,3-dioxoisoindol-2-yl)hexanamide Traditional Name: N-(5-chloro-2-methoxy-4-nitro-phenyl)-6-phthalimido-hexanamide Formula: C21H20ClN3O6 MolecularWeight: 445.853

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H20ClN3O6/c1-31-18-12-17(25(29)30)15(22)11-16(18)23-19(26)9-3-2-6-10-24-20(27)13-7-4-5-8-14(13)21(24)28/h4-5,7-8,11-12H,2-3,6,9-10H2,1H3,(H,23,26)