3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propyl cyclohexanecarboxylate

Systemtic Name: 3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propyl cyclohexanecarboxylate Openeye Name: 3-(5-bromo-1,3-dioxo-isoindolin-2-yl)propyl cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid 3-(5-bromo-1,3-dioxo-2-isoindolyl)propyl ester IUPAC Name: 3-(5-bromo-1,3-dioxoisoindol-2-yl)propyl cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid 3-(5-bromo-1,3-diketo-isoindolin-2-yl)propyl ester Formula: C18H20BrNO4 MolecularWeight: 394.2597

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)OCCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

C1CCC(CC1)C(=O)OCCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C18H20BrNO4/c19-13-7-8-14-15(11-13)17(22)20(16(14)21)9-4-10-24-18(23)12-5-2-1-3-6-12/h7-8,11-12H,1-6,9-10H2