N-[3-chloranyl-4-(diethylcarbamoyl)phenyl]-2-methyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-[3-chloranyl-4-(diethylcarbamoyl)phenyl]-2-methyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-[3-chloro-4-(diethylcarbamoyl)phenyl]-2-methyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[3-chloro-4-[diethylamino(oxo)methyl]phenyl]-2-methyl-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-[3-chloro-4-(diethylcarbamoyl)phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-[3-chloro-4-(diethylcarbamoyl)phenyl]-1,3-diketo-2-methyl-isoindoline-5-carboxamide Formula: C21H20ClN3O4 MolecularWeight: 413.8542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O4/c1-4-25(5-2)21(29)15-9-7-13(11-17(15)22)23-18(26)12-6-8-14-16(10-12)20(28)24(3)19(14)27/h6-11H,4-5H2,1-3H3,(H,23,26)