N-(2-chloranyl-4,6-dimethyl-phenyl)-2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-(2-chloranyl-4,6-dimethyl-phenyl)-2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-(2-chloro-4,6-dimethyl-phenyl)-2-(3-methoxypropyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-(2-chloro-4,6-dimethylphenyl)-2-(3-methoxypropyl)-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-(2-chloro-4,6-dimethylphenyl)-2-(3-methoxypropyl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-(2-chloro-4,6-dimethyl-phenyl)-1,3-diketo-2-(3-methoxypropyl)isoindoline-5-carboxamide Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCCOC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCCOC)C

InChI

InChI=1S/C21H21ClN2O4/c1-12-9-13(2)18(17(22)10-12)23-19(25)14-5-6-15-16(11-14)21(27)24(20(15)26)7-4-8-28-3/h5-6,9-11H,4,7-8H2,1-3H3,(H,23,25)