N-(2-chloranyl-4,5-dimethoxy-phenyl)-2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-(2-chloranyl-4,5-dimethoxy-phenyl)-2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-(2-chloro-4,5-dimethoxy-phenyl)-2-(3-methoxypropyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-(2-chloro-4,5-dimethoxyphenyl)-2-(3-methoxypropyl)-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-(2-chloro-4,5-dimethoxyphenyl)-2-(3-methoxypropyl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-(2-chloro-4,5-dimethoxy-phenyl)-1,3-diketo-2-(3-methoxypropyl)isoindoline-5-carboxamide Formula: C21H21ClN2O6 MolecularWeight: 432.85424

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC(=C(C=C3Cl)OC)OC

Isomeric SMILES

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC(=C(C=C3Cl)OC)OC

InChI

InChI=1S/C21H21ClN2O6/c1-28-8-4-7-24-20(26)13-6-5-12(9-14(13)21(24)27)19(25)23-16-11-18(30-3)17(29-2)10-15(16)22/h5-6,9-11H,4,7-8H2,1-3H3,(H,23,25)