2-cyclohexyl-N-[2-(2-methylpropanoylamino)ethyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-cyclohexyl-N-[2-(2-methylpropanoylamino)ethyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-cyclohexyl-N-[2-(2-methylpropanoylamino)ethyl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-cyclohexyl-N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-cyclohexyl-N-[2-(2-methylpropanoylamino)ethyl]-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-cyclohexyl-N-[2-(isobutyrylamino)ethyl]-1,3-diketo-isoindoline-5-carboxamide Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3CCCCC3

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3CCCCC3

InChI

InChI=1S/C21H27N3O4/c1-13(2)18(25)22-10-11-23-19(26)14-8-9-16-17(12-14)21(28)24(20(16)27)15-6-4-3-5-7-15/h8-9,12-13,15H,3-7,10-11H2,1-2H3,(H,22,25)(H,23,26)