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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(5-chloranyl-2-methoxy-4-nitro-phenyl)-3-methyl-butanamide Openeye Name: N-(5-chloro-2-methoxy-4-nitro-phenyl)-2-(1,3-dioxoisoindolin-2-yl)-3-methyl-butanamide CAS Name: N-(5-chloro-2-methoxy-4-nitrophenyl)-2-(1,3-dioxo-2-isoindolyl)-3-methylbutanamide IUPAC Name: N-(5-chloro-2-methoxy-4-nitrophenyl)-2-(1,3-dioxoisoindol-2-yl)-3-methylbutanamide Traditional Name: N-(5-chloro-2-methoxy-4-nitro-phenyl)-3-methyl-2-phthalimido-butyramide Formula: C20H18ClN3O6 MolecularWeight: 431.82642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC(=C(C=C1OC)[N+](=O)[O-])Cl)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)C(C(=O)NC1=CC(=C(C=C1OC)[N+](=O)[O-])Cl)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H18ClN3O6/c1-10(2)17(23-19(26)11-6-4-5-7-12(11)20(23)27)18(25)22-14-8-13(21)15(24(28)29)9-16(14)30-3/h4-10,17H,1-3H3,(H,22,25)