N-(1-adamantylmethyl)-2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide

Systemtic Name: N-(1-adamantylmethyl)-2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide Openeye Name: N-(1-adamantylmethyl)-2-(5-bromo-1,3-dioxo-isoindolin-2-yl)propanamide CAS Name: N-(1-adamantylmethyl)-2-(5-bromo-1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-(1-adamantylmethyl)-2-(5-bromo-1,3-dioxoisoindol-2-yl)propanamide Traditional Name: N-(1-adamantylmethyl)-2-(5-bromo-1,3-diketo-isoindolin-2-yl)propionamide Formula: C22H25BrN2O3 MolecularWeight: 445.3495

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC12CC3CC(C1)CC(C3)C2)N4C(=O)C5=C(C4=O)C=C(C=C5)Br

Isomeric SMILES

CC(C(=O)NCC12CC3CC(C1)CC(C3)C2)N4C(=O)C5=C(C4=O)C=C(C=C5)Br

InChI

InChI=1S/C22H25BrN2O3/c1-12(25-20(27)17-3-2-16(23)7-18(17)21(25)28)19(26)24-11-22-8-13-4-14(9-22)6-15(5-13)10-22/h2-3,7,12-15H,4-6,8-11H2,1H3,(H,24,26)